1. Mohamed Hichem Gazzah, Large magnetocaloric effect in 0.25(La0.67Ca0.33MnO3 + La0.67Ca0.13Sr0.2Mn0.98Ni0.02O3) /0.5 La0.67Ca0.23Sr0.1Mn0.98Ni0.02O3 composite close to room temperature, European Physical Journal Plus (2022)

2. Mohamed Hichem Gazzah, Sensitive Detection of SARS‐CoV‐2 Using a Novel Plasmonic Fiber Optic Biosensor Design, Plasmonics (2022)

3. Mohamed Hichem Gazzah, InxGa1-xN/GaN double heterojunction solar cell optimization for high temperature operation, Solar Energy Materials and Solar Cells (2022)

4. Mohamed Hichem Gazzah, Impact of piezoelectric polarization on the performance of InGaN/GaN p–i–n solar cells with Ga- and Nface polarity, European Physical Journal Plus (2022)

5. Sameh Kaziz, Mohamed Hichem Gazzah, 3D simulation of microfluidic biosensor for SARS-CoV-2 S protein binding kinetics using new reaction surface design, Europeqn Physicql Journql Plus (2022)

6. Sameh Kaziz, Med Hichem Gazzah, Design parameters optimization of an electrothermal flow biosensor for the SARS-CoV-2 S protein immunoassay, Indian J Phys (2022)

7. Sameh Kaziz, Taguchi optimization of integrated flow microfluidic biosensor for COVID-19 detection, The European Physical Journal Plus (2022)

8. Radhouane LAAJIMI, A novel efficient coplanar QCA full adder and full subtractor design, International Journal of Electronics (2022)

9. Nadia Bouaziz, Aabdelmottaleb Ben Lamine, Experimental and theoretical investigation of absorption and desorption of hydrogen in the LaNi4Co0.5Mn0.5 alloy, Chemical Engineering Science (2022)

10. Nadia Bouaziz, Abdelmottaleb Ben Lamine, Adsorption of methyl orange, acid chrome blue K, and Congo red dyes on MIL-101-NH2adsorbent: Analytical interpretation via advanced model, AIP Advances (2022) 

11. Nadia Bouaziz, Abdelmottaleb Ben Lamine, Adsorption of CO2 on ZSM-5 Zeolite: Analytical Investigation via a Multilayer Statistical Physics Model, Applied Sciences (Switzerland) (2022)

12. Mohamed Bouzid, Abdelmottaleb Ben Lamine, CO2 adsorption by molecular sieve 10A°, experimental and theoretical examination via statistical physics: modeling macroscopic and microscopic investigation, Separation Science and Technology (2022)

13. Mohamed Bouzid, Synthesis and preparation of acid capped CdSe nanocrystals as successful adsorbent and photocatalyst for the removal of dyes from water and its statistical physics analysis, Environmental Science and Pollution Research (2022)

14. Mohamed Bouzid, A comprehensive review on green perspectives of electrocoagulation integrated with advanced processes for effective pollutants removal from water environment, Environmental Research (2022)

15. Marwa Atrous, Yosra Ben Torkia, Mohamed Bouzid, Abdelmottaleb Ben Lamine, Statistical physics treatment of tetracycline adsorption: energetic studies, Chemical Papers (2022)

16. Wouroud Sghaier, Yosra Ben Torkia, Abdelmaottaleb Ben Lamine, Thermodynamic analysis of cooling cycles based on statistical physics modeling of ethanol adsorption isotherms, International Journal of Refrigeration (2022)

17. Lotfi Sellaoui, Performance and interactions of diclofenac adsorption using Alginate/Carbon-based Films: Experimental investigation and statistical physics modelling, Chemical Engineering Journal (2022)

18. Lotfi Sellaoui, Thermodynamics and Mechanism of the Adsorption of Heavy Metal Ions on Keratin Biomasses for Wastewater Detoxification, Adsorption Science & Tchnology (2022) 

19. Lotfi Sellaoui, New Interpretations of the Adsorption Process of Tetracycline on Biochar via Experimental and TheoreticalStudies, Water (2022)

20. Fatma Dhaouadi, Lotfi Sellaoui, Enhanced adsorption of ketoprofen and 2,4-dichlorophenoxyactic acid on Physalis peruviana fruit residue functionalized with H2SO4: Adsorption properties and statistical physics modeling, Chemical Engineering Journal (2022)

21. Lotfi Sellaoui, Fatma Dhaouadi, Abdemottaleb Ben Lamine, Modeling the adsorption of divalent metallic cations onto multi-walled carbon nanotubes functionalized with COOH, Journal of Molecular Liquids (2022)

22. Fatma Dhaouadi, Lotfi Sellaoui, Abdelmottaleb Ben Lamine, Statistical physics modeling and evaluation ofadsorption properties of chitosan-zinc oxide nanocomposites for the removal of an anionic dye, Journal of Environmental Chemical (2022)

23. Fatma Dhaouadi, Lotfi Sellaoui, Abdelmottaleb Ben Lamine, Using an enhanced multilayer model to analyze the performance of nickel alginate/graphene oxide aerogel, nickel alginate aerogel/activated carbon, and activated carbon in the adsorption of a textile dye pollutant, Environmental Science and Pollution Research (2022)

24. Fatma Dhaouadi, Lotfi Sellaoui, Abdelmottaleb Ben Lamine, Adaptation of advanced physical models to interpret the adsorption isotherms of lead and cadmium ions onto activated carbon in single-compound and binary systems, Environmental Science and Pollution Research (2022)

25. Lotfi Sellaoui, Fatma Daouadi, Abdelmottaleb Ben Lamine, Understanding the Cu2+ adsorption mechanism on activated carbon using advanced statistical physics modelling, Environmental Science and Pollution Research (2022)

26. Lotfi Sellaoui, Fatma Dhaouadi, Abdelmottaleb Ben Lamine, Application of a multilayer physical model for the critical analysis of the adsorption of nicotinamide and propranolol on magnetic-activated carbon, Environmental Science and Pollution Research (2022)

27. Fatma Dhaouadi, Lotfi Sellaoui, Abdelmottaleb Ben Lamine, Adsorption of methylene blue from aqueous solution on activated carbons and composite prepared from an agricultural waste biomass: A comparative study by experimental and advanced modeling analysis, Chemical Engineering Journal (2022)

28. Ismahene Ben Khemis, Smati Houda, Ben Lamine Abdelmottaleb, Interpretation the olfactory perception of musk tibetene, muscone and dihydrocivetone on the human musk olfactory receptor OR5AN1 via an advanced statistical physics modeling, Journal of Molecular Liquids (2022)

29. Ismahene Ben Khemis, Olfa Noureddine, Ben Lamine Abdelmottaleb,  Indirect characterizations of mOR-EG: Modeling analysis of five concentration-olfactory response curves via an advanced monolayer adsorption model, International Journal of Biological Macromolecules (2022)

30. Ismahene Ben Khemis, Ben Lamine Abdelmottaleb, Theoretical study of the olfactory perception of floral odorant on OR10J5 and Olfr16 using the grand canonical ensemble in statistical  hysics approach, International Journal of Refrigeration (2022)

31. Kods Oueslatia, Abdellatif Saklya, Abdelmottaleb Ben Lamine, Statistical and physical interpretation of dye adsorption onto low-cost biomass by using simulation methods, Journal of Molecular Liquids (2022)

32. Kods Oueslati, Abdellatif Sakly, Abdelmottaleb Ben Lamine, Statistical and physical interpretation of dye adsorption onto low-cost biomass by using simulation methods, Colloids and Surfaces A: Physicochemical and Engineering Aspects (2022)

33. Salah Knani,  Adsorption and Photocatalytic Degradation of Pesticides into Nanocomposites: A Review, Molecules (2022)

34. Salah Knani, Study of moisture adsorption isotherms characteristics of banana and thermodynamic properties using statistical physics formalism, Drying Technology (2022)

35. Noureddine Issaoui, Sulfation of Wheat Straw Soda Lignin with Sulfamic Acid over Solid Catalysts, Biomolecules (2022)

36. Noureddine Issaoui, Assembly of two new hybrid chloride materials with potential NLO properties: Structure elucidation, empirical and computational studies, Journal of the Iranian Chemical Society volume (2022)

37. Noureddine Issaoui, A DFT Study of the Hydrogen Bonded Structures of Pyruvic Acid–Water Complexes, Frontiers in Physics (2022)

38. Noureddine Issaoui, Synthesis, characterization, and computational survey of a novel material template o-xylylenediamine, Journal of the Iranian Chemical Society (2022)

39. Noureddine Issaoui, Experimental and theoretical investigations on structural-function relationship of new iron (III) complex with 2-(Ammoniomethyl)pyridinium cation as ligand: A promising material for green solar cells, Journal of Molecular Structure (2022)

40. Noureddine Issaoui, A density functional theory calculations of infrared spectra of galactomannan butyl ether, Journal of Molecular Structure (2022)

41. Noureddine Issaoui, Synthesis, crystal structure, spectroscopic, antidiabetic, antioxidant and computational investigations of Ethyl 5-hydroxy-1-isonicotinoyl-3-methyl-4,5-dihydro-1H-pyrazole-5-carboxylate, (2022)

42. Noureddine Issaoui, Deciphering non-covalent interactions of 1,3-Benzenedimethanaminium bis(trioxonitrate): Synthesis, empirical and computational study, Journal of Molecular Structure (2022)

43. Noureddine Issaoui, Catalytic Sulfation of Betulin with Sulfamic Acid: Experiment and DFT Calculation, International Journal of Molecular Sciences (2022)

44. Noureddine Issaoui, Non covalent interactions analysis and spectroscopic characterization combined with molecular docking study of N′-(4-Methoxybenzylidene)-5-phenyl-1H-pyrazole-3-carbohydrazide, Journal of King Saud University - Science (2022)

45. Noureddine Issaoui, Hydrogen bonds interactions in biuret-water clusters: FTIR, X-ray diffraction, AIM, DFT, RDG, ELF, NLO analysis, Journal of King Saud University - Science (2022)

46. Noureddine Issaoui, Self-assembly of a new cobalt complex, (C6H14N2)3[CoCl4]Cl: Synthesis, empirical and DFT calculations, Journal of King Saud University (2022)

47. Noureddine Issaoui, Physico-Chemical Properties, Pharmacokinetics, Molecular Docking and In-Vitro Pharmacological Study of a Cobalt (II) Complex Based on 2-Aminopyridine, Chemistry Select (2022)

48. Noureddine Issaoui, Molecular structure, spectroscopy, quantum chemical and antibacterial activity investigations of 2-methylbenzylammonium perchlorate, Journal of Molecular Structure (2022)

49. Noureddine Issaoui, DFT Calculations of Some Important Radicals Used in the Nitroxide-Mediated Polymerization and Their HOMO‒LUMO, Natural Bond Orbital, and Molecular Electrostatic Potential Comparative Analysis, Polymer Science (2022)

50. Noureddine Issaoui, Sulfation of Diethylaminoethyl Cellulose with Chlorosulfonic Acid in 1,4-dioxane, Journal of Siberian Federal University: Chemistry (2022)

51. Noureddine Issaoui, 3-Chloro-3-methyl-2,6-diarylpiperidin-4-ones as Anti-Cancer Agents: Synthesis, Biological Evaluation, Molecular Docking, and In Silico ADMET Prediction, Biomolecules (2022)

52. Noureddine Issaoui, New reactions of betulin with sulfamic acid and ammonium sulfamate in the presence of solid catalysts, Biomass Conversion and Biorefinery (2022)

53. Noureddine Issaoui, Sulfation of arabinogalactan with ammonium sulfamate, Biomass Conversion and Biorefinery (2022)

54. Noureddine Issaoui, Molecular Characteristics and Antioxidant Activity of Spruce (Picea abies) Hemicelluloses Isolated by Catalytic Oxidative Delignification, Molecules (2022)

55. Noureddine Issaoui, Composition and Structure of Aspen (Pópulus trémula) Hemicelluloses Obtained by Oxidative Delignification, Polymers (2022)

56. Noureddine Issaoui, Synthesis, spectroscopic, topological, hirshfeld surface analysis, and anticovid-19 molecular docking investigation of isopropyl 1-benzo yl-4-(benzoyloxy)- 2,6-diphenyl-1,2,5 , 6-tetrahydropyridine-3-carboxylate, Heliyon (2022)

61. Soulef Jellali, Héla Habli, Non-Relativistic Electronic-Structure Computation of Neutral and Cationic Systems [Fr2, Fr−AEM+ (AEM= Ca, Sr, Ba)], The Journal of Physical Chemistry A (2022)

62. Héla Habli, Soulef Jellali, Computational study of the electronic structure of the Srm+Kr (m = 0, 1) van der Waals complexes, Physica Scripta (2022)

63. Hela Habli, Houcine Ghala, Microsolvation of lithium cation in xenon clusters: An octahedral growth pattern, Journal of Molecular Graphics and Modelling (2022)

64. Houcine Ghalla, Spectroscopic characterization, host-guest charge transfer, Hirshfeld surfaces, AIM-RDG and ELF study of adsorption and chemical sensing of heavy metals with new derivative of Calix [4]quinone: A DFT-D3 computation, Materials Chemistry and Physics (2022)

65. Houcine Ghalla, Low pH-induced lone-pair activity in the hybrid (C6H10N2)[SnCl3]Cl: Chemical study and physical characterizations, Journal of Molecular Structure (2022)  

66. Houcine Ghalla, Azo-methoxy-calix[4]arene complexes with metal cations for chemical sensor applications: Characterization, QTAIM analyses and dispersion-corrected DFT- computations, Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy (2022)

67. Houcine Ghalla, Novel 3-phenyl-1- (alkylphenyl)-9-oxa-4-azaphenanthren-10-ones as inhibitors of some enzymes: synthesis, characterization, biological evaluation and molecular docking studies, Journal of Biomolecular Structure and Dynamics (2022)

68. Houcine Ghalla, Adsorption of toxic and non-toxic metals with new model of CX[4]: Experimental and computational investigation, Spectroscopic, QTAIM, and Antibacterial activity analyses, Journal of Molecular Structure (2022)

69. Houcine Ghalla, Stability, spectroscopic, electrochemistry and QTAIM analysis of CuZnn−1On clusters for glucose sensing application: A study on theoretical and experimental insights, Heliyon (2022)

70. Houcine Ghalla, Investigation of optical, TD-DFT calculation and electrical conductivity in semiconducting [(CH3)NH3]2ZnBr4, Journal of Molecular Structure (2022)

71. Houcine Ghalla, New cadmium(II) porphyrin-based coordination dimer: Experimental and theoretic studies, Journal of Solid State Chemistry (2022)

72. Houcine Ghalla, Use of tetraphenyl (hydroxyl) imidazole for colorimetric detection of iodide: Optical properties, computational characterizations, NBO, QTAIM, and NCI-RDG analyses, Inorganic Chemistry Communications (2022)

73. Hanen Souissi, Radiative Lifetimes for the A and C1 Σ+ States of the (SrK)+ Ion Molecular, Applied Sciences (Switzerland) (2022)

74. Sondes Boughammoura, Jalel M'halla, Micellization and aggregation approach in aqueous amphiphilic ionic liquid and anionic polymer system, Chemical Thermodynamics and Thermal Analysis (2022)

75. Anis Ghazouani, Jalel M'halla, Sondes Boughammoura, Dependency of the mobility of carboxymethylated cellulosic polyions on the nature of their counterions, Journal of Molecular Liquids (2022)

76. Malek Mazouz, Deeply Virtual Compton Scattering Cross Section at High Bjorken xB, Physical Review Letters (2022)

77. Ahmed Fradi, Beam-spin asymmetry Σ for Σ− hyperon photoproduction off the neutron, Physics Letters, Section B: Nuclear, Elementary Particle and HighEnergy Physics (2022)

78. Jemii Elassaad, Electrothermal analyses in Cu/ZrO2/Pt CBRAM memory using a dual phase-lag model, Journal of Computational Electronics (2022)

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2. Rowley et al. [including Fradi A.], Improved Λp Elastic Scattering Cross Sections between 0.9 and as a Main Ingredient of the Neutron Star Equation of State, Physical review letters 127 (27), 272303 (2021).

3. Echouchene, F., Jemii, E., Analysis of the transient Joule heating effect in a conductive-bridge random-access memory (CBRAM) using a single-phase-lag (SPL) model, J. Comp. Elec. 20(3), 1422 (2021).

4. Accardi, A. et al. [including Mazouz M.], An experimental program with high duty-cycle polarized and unpolarized positron beams at Jefferson Lab, The European Physical Journal A 57 (8), 261 (2021)

5. Afanasev, A. et al. [including Mazouz M.], Deeply virtual Compton scattering using a positron beam in Hall-C at Jefferson Lab, The European Physical Journal A 57 (10), 300 (2021).

6. Zhao, S., Camsonne, A., Marchand, D. Mazouz M. et al., Double deeply virtual Compton scattering with positron beams at SoLID, The European Physical Journal A 57 (7), 240 (2021).

7. Jalel Mhalla, Sondes Boughammoura, Anis Ghazouani, Translational dielectric friction on a pearl-necklace-like polyelectrolyte chain, Journal of Molecular Liquids 326(3):115173 - January 2021.

8. K. Laajimi, F. Ayadi, M.K Chaw, I. Fourati, M. Khlifi, M.H. Gazzah, J. Dhahri, J. Juraszek, A new range of specific perovskite-type materials with structural, magnetic and magnetocaloric properties: La0.67Ca0.33-xSrxMn0.98Fe0.02O3 (0.15 ≤ x ≤ 0.3), Solid State Sciences, 119, 2021, 106683.

9. Sameh Kaziz, Yosra Saad, Mohamed Bouzid, Marwa Selmi, Hafedh Belmabrouk, Enhancement of COVID-19 detection time by means of electrothermal force, Microfluidics and Nanofluidics 25 (2021) 86.

10. Y. Saad, M. Selmi, M.H. Gazzah, H. Belmabrouk,The magnetic field effect on the improvement of the b inding reaction of C-reactive protein at the microfluidic channel surface of an SPR biosensor, European Physical Journal Plus, 2021, 136(5), 608.

11. H. Chtioui, K. Bouchlaghem, M.H. Gazzah, Investigation of Saharan dust influence on PM10 concentration using two methods in Gabès, Tunisia, Arabian Journal of Geosciences, 2021, 14(10), 908.

12. K. Bouchlaghem, H. Chtioui, M.H. Gazzah, Analyzing the impact of Saharan sand and dust storms based on HYSPLIT algorithm in Tunisian regions, Arabian Journal of Geosciences, 2021, 14(10), 834.

13. Mouna Harzallah, Mouna Medimagh, Noureddine Issaoui, Thierry Roisnel & Ayed Brahim, Synthesis, X-ray crystal structure, Hirshfeld surface analysis, DFT, AIM, ELF, RDG and molecular docking studies of bis[4-(dimethylamino)pyridinium]di-µ- hloridobis [dichloridom ercurate(II)], Journal of Coordination Chemistry.

14. M. Ben Hadj Ayed, S. Mtiri, H. Ghalla, Adiabatic investigation of the electronic and dipolar properties of the LiNe system in ground state and numerous excited states, J. Quant. Spectrosc. Radiat. Transf. 274 (2021) 107864.

15. B. Gassoumi, F.E. Ben Mohamed, M.E. Castro, F.J. Melendez, A. Karayel, L. Nouar, F. Madi, H. Ghalla, S. Özkınalı, V.I. Kovalenko, R. Ben Chaabane, H. Ben Ouada, In silico exploration of O-H…X2+ (X = Cu, Ag, Hg) interaction, targeted adsorption zone, charge density iso-surface, O-H proton analysis and topographic parameters theory for calix[6]arene and calix[8]arene as model, J. Mol. Liq. 334 (2021) 116127.

16. M. Chaabene, R. Soury, H. Ghalla, M. Jabli, R. Ben Chaâbane, A.R. Allouchef, Insights into theoretical detection of CO2, NO, CO, O2, and O3 gases molecules using Zinc phthalocyanine with peripheral mono and tetra quinoleinoxy substituents: Molecular geometries, Electronic properties, and Vibrational analysis, Chem. Phys. 547 (2021) 111198.

17. N. Aouled Dlala, Y. Bouazizi, H. Ghalla, N. Hamdi, DFT Calculations and Molecular Docking Studies on a Chromene Derivative, Jchem 2021 (2021) 6674261.

18. M. Laajimi, H. Ghalla, S. Mtiri, Solvation of potassium cation in helium clusters: Density functionaltheory versus pairwise method, J. Mol. Graph. Model. 106 (2021) 107912.

19. B. Gassoumi, F. E. Ben Mohamed, N. Khedmi, A. Karayel, M. Echabaane, H. Ghalla, S. Özkınalı, R. Ben. Chaabane, Theoretical assessment of calix[4]arene-N-β-ketoimine (n=1–4) derivatives: Conformational studies, optoelectronic, and sensing of Cu2+ cation, J. Mol. Mod. (2021) 27:16.

20. H. Habli, S. Jellali, B. Oujia. Electronic, structural and vibrational properties of calcium monohydride, Physica Scripta, 95, 015403 (2020).

21. Alrebdi Tahani A., Souissi Hanen, Alkallas, F.H., Aouaini, F. ‘Ab initio adiabatic study of the AgH system’ Scientific Reports, 2021, 11(1), 8277.

22. Hanen Souissi, Mohamed Ben Yahia, Application of Innovative Analytical Modeling for the Physicochemical Analysis of Adsorption Isotherms of Silver Nitrate on Helicenes: Phenomenological Study of the Complexation Process. Adsorption Science & Technology, Volume 2021, Article ID 6619389, 14 pages.

23. Kazachenko, A.S., Akman, F., Malyar, Y.N., ISSAOUI, N., Vasilieva, N.Y., Karacharov, A.A. Synthesis optimization, DFT and physicochemical study of chitosan sulfates (2021) Journal of Molecular Structure, 1245, art. no. 131083.

24. Ramalingam, A., Sambandam, S., Medimagh, M., Al-Dossary, O., Issaoui, N., Wojcik, M.J. Study of a new piperidone as an anti-Alzheimer agent: Molecular docking, electronic and intermolecular interaction investigations by DFT method (2021) Journal of King Saud University - Science, 33 (8), art. no. 101632.

25. Medimagh, M., Issaoui, N., Gatfaoui, S., Al-Dossary, O., S. Kazachenko, A., Marouani, H., Wojcik, M.J. Molecular modeling and biological activity analysis of new organic-inorganic hybrid: 2-(3,4-dihydroxyphenyl) ethanaminium nitrate (2021) Journal of King Saud University - Science, 33 (8), art. no. 101616.

26. Sagaama, A., Issaoui, N., Al-Dossary, O., Kazachenko, A.S., Wojcik, M.J. Non covalent interactions and molecular docking studies on morphine compound (2021) Journal of King Saud University - Science, 33 (8), art. no. 101606.

27. Kazachenko, A.S., Akman, F., Abdelmoulahi, H., Issaoui, N., Malyar, Y.N., Al-Dossary, O., Wojcik, M.J. Intermolecular hydrogen bonds interactions in water clusters of ammonium sulfamate: FTIR, X-ray diffraction, AIM, DFT, RDG, ELF, NBO analysis (2021) Journal of Molecular Liquids, 342, art. no. 117475.

28. Kazachenko, A.S., Vasilieva, N.Yu., Borovkova, V.S., Fetisova, O.Yu., Issaoui, N., Malyar, Y.N., Elsuf’ev, E.V., Karacharov, A.A., Skripnikov, A.M., Miroshnikova, A.V., Kazachenko, A.S., Zimonin, D.V., Ionin, V.A. Food xanthan polysaccharide sulfation process with sulfamic acid (2021) Foods, 10 (11), art. no. 2571.

29. Jomaa, I., Issaoui, N., Roisnel, T., Marouani, H. Insight into non-covalent interactions in a tetrachlorocadmate salt with promising NLO properties: Experimental and computational analysis (2021) Journal of Molecular Structure, 1242, art. no. 130730.

30. Medimagh, M., Issaoui, N., Gatfaoui, S., Brandan, S.A., Al-Dossary, O., Marouani, H., Wojcik, M.J. Impact of non-covalent interactions on FT-IR spectrum and properties of 4-methylbenzylammonium nitrate. A DFT and molecular docking study (2021) Heliyon, 7 (10), art. no. e08204.

31. Ben Khemis, I., Sagaama, A., Issaoui, N., Ben Lamine, A. Steric and energetic characterizations of mouse and human musk receptors activated by nitro musk smelling compounds at molecular level: Statistical physics treatment and molecular docking analysis (2021) International Journal of Biological Macromolecules, 188, pp. 333-342.

32. Kazachenko, A., Akman, F., Medimagh, M., Issaoui, N., Vasilieva, N., Malyar, Y.N., Sudakova, I.G., Karacharov, A., Miroshnikova, A., Al-Dossary, O.M. Sulfation of Diethylaminoethyl-Cellulose: QTAIM Topological Analysis and Experimental and DFT Studies of the Properties (2021) ACS Omega, 6 (35), pp. 22603-22615.

33. Malyar, Y.N., Vasilyeva, N.Yu., Kazachenko, A.S., Borovkova, V.S., Skripnikov, A.M., Miroshnikova, A.V., Zimonin, D.V., Ionin, V.A., Kazachenko, A.S., Issaoui, N. Modification of arabinogalactan isolated from larix sibirica Ledeb. Into sulfated derivatives with the controlled molecular weights (2021) Molecules, 26 (17), art. no. 5364.

34. Gatfaoui, S., Issaoui, N., Noureddine, O., Roisnel, T., Marouani, H. Self assembly of a novel Cu(II) complex, (C6H9N2)2[CuCl4]: experimental, computational, and molecular docking survey (2021) Journal of the Iranian Chemical Society, 18 (9), pp. 2331-2343.

35. Hamdi, I., Mhadhbi, N., Issaoui, N., Roodt, A., Turnbull, M.M., Naϊli, H. Design, synthesis and physico-chemical studies of a Co(II)/Co(III) mixed-valence complex: An experimental and DFT approach (2021) Journal of Molecular Structure, 1237, art. no. 130384.

36. Fradi, T., Noureddine, O., Taheur, F.B., Guergueb, M., Nasri, S., Amiri, N., Almahri, A., Roisnel, T., Guerineau, V., Issoui, N., Nasri, H. New DMAP meso-arylporphyrin Magnesium(II) complex. Spectroscopic, Cyclic voltammetry and X-ray molecular structure characterization. DFT, DOS and MEP calculations and Antioxidant and Antifungal activities (2021) Journal of Molecular Structure, 1236, art. no. 130299.

37. Hammami, F., Issaoui, N., Nasr, S. Investigation of hydrogen bonded structure of urea-water mixtures through Infra-red spectroscopy and non-covalent interaction (NCI) theoretical approach (2021) Computational and Theoretical Chemistry, 1199, art. no. 113218.

38. Chortani, S., Horchani, M., Znati, M., Issaoui, N., Jannet, H.B., Romdhane, A. Design and synthesis of new benzopyrimidinone derivatives: α-amylase inhibitory activity, molecular docking and DFT studies (2021) Journal of Molecular Structure, 1230, art. no. 129920, .

39. Daghar, C., Issaoui, N., Roisnel, T., Dorcet, V., Marouani, H. Empirical and computational studies on newly synthesis cyclohexylammonium perchlorate (2021) Journal of Molecular Structure, 1230, art. no. 129820, .

40. Noureddine, O., Issaoui, N., Medimagh, M., Al-Dossary, O., Marouani, H. Quantum chemical studies on molecular structure, AIM, ELF, RDG and antiviral activities of hybrid hydroxychloroquine in the treatment of COVID-19: Molecular docking and DFT calculations (2021) Journal of King Saud University - Science, 33 (2), art. no. 101334, .

41. Noureddine, O., Issaoui, N., Gatfaoui, S., Al-Dossary, O., Marouani, H. Quantum chemical calculations, spectroscopic properties and molecular docking studies of a novel piperazine derivative (2021) Journal of King Saud University - Science, 33 (2), art. no. 101283, .

42. Gatfaoui, S., Issaoui, N., Roisnel, T., Marouani, H. Synthesis, experimental and computational study of a non-centrosymmetric material 3-methylbenzylammonium trioxonitrate (2021) Journal of Molecular Structure, 1225, art. no. 129132, .

43. Tahenti, M., Issaoui, N., Roisnel, T., Marouani, H. Synthesis, characterization, and computational survey of a novel material template o-xylylenediamine (2021) Journal of the Iranian Chemical Society.

44. Kazachenko, A.S., Malyar, Y.N., Vasilyeva, N.Y., Borovkova, V.S., Issaoui, N. Optimization of guar gum galactomannan sulfation process with sulfamic acid (2021) Biomass Conversion and Biorefinery.

45. Kazachenko, A.S., Akman, F., Sagaama, A., Issaoui, N., Malyar, Y.N., Vasilieva, N.Y., Borovkova, V.S. Theoretical and experimental study of guar gum sulfation (2021) Journal of Molecular Modeling, 27 (1), art. no. 5.

46. Noureddine, O., Issaoui, N., Al-Dossary, O. DFT and molecular docking study of chloroquine derivatives as antiviral to coronavirus COVID-19 (2021) Journal of King Saud University - Science, 33 (1), art. no. 101248.

47. S. Jellali, H. Habli. FCI Calculations of the Adiabatic Electronic Structure of KRb Highlighting the K-Rb+ Ionic Limit. Journal of Quantitative Spectroscopy and Radiative Transfer. 276, 107897 (2021).

48. Fatma Dhaouadi, Lotfi Sellaoui, Luis Enrique Hernández-Hernández, Adrián Bonilla-Petriciolet, Didilia Ileana Mendoza-Castillo, Hilda Elizabeth, Reynel-Ávila, Herson Antonio González-Ponce, Sonia Taamalli, Florent Louis, Abdelmottaleb Ben Lamine. Preparation of an avocado seed hydrochar and its application as heavy metal adsorbent: Properties and advanced statistical physics modeling, Chemical Engineering Journal 419 (2021) 129472.

49. Nadia Bouaziz, Fatma Aouaini, Yosra Ben Torkia, Abeer S.Altowyan, Abdelmottaleb Ben Lamine. Advanced interpretation of hydrogen absorption process in LaMgNi3.6M0.4 (M = Ni, Mn, Al, Co, Cu) alloys using statistical physics treatment, International Journal of Hydrogen Energy 46 (2021) 10389-10395.

50. Ismahene Ben Khemis, Mohamed Bouzid, Nesrine Mechi, AbdelmottalebBen Lamine. Statistical physics modeling and interpretation of the adsorption of enantiomeric terpenes onto the human olfactory receptor OR1A1, International Journal of Biological Macromolecules 171 (2021) 428-434.

51. Wouroud Sghaier, YosraBen Torkia, MohamedBouzid, AbdelmottalebBen Lamine. CO2 adsorption investigation by statistical physics: Thermodynamic analysis for cooling cycle application, Journal of Environmental Chemical Engineering 9 (2021) 105108.

52. Yosra Ben Torkia, Wouroud Sghaier, Nadia Bouaziz, Abdelmottaleb Ben Lamine. Xenon adsorption isotherms on chabazite. Statistical physics modeling investigation: Adsorption energy and pore size distributions computation, Journal of Environmental Chemical Engineering 9 (2021) 104733.

53. Ismahene Ben Khemis, Kods Oueslati, Mohamed Bouzid, Nesrine Mechi, Sarra Wjihi, Abdelmottaleb Ben Lamine. Interpretations of key food odorant dose-olfactory response curves using statistical physics method, Journal of Molecular Liquid 322 (2021) 114553.

54. Sarra Wjihi, Fatma Aouaini, Alessandro Erto, Marco Balsamo, Abdelmottaleb Ben Lamine. Advanced interpretation of CO2 adsorption thermodynamics onto porous solids by statistical physics formalism, Chemical Engineering Journal 406 (2021) 126669.

55. Lotfi Sellaoui, Samia Yahyaoui, SoniaTaamalli, Zainab Srour, Dison Franco, Matias Schadeck Netto, Jordana Georgin, Adrián Bonilla-Petriciolet, Florent Louis, Abderrahman El Bakali, Valérie Fèvre-Nollet, Guilherme Luiz Dotto, Alessandro Erto, Abdemottaleb Ben Lamine, Zhuqi Chen, A study of single and quaternary adsorption of Cu2+, Co2+, Ni2+ and Ag+ on sludge modified by alkaline fusion, Chemical Engineering Journal (2021) 133674.

56. Fatma Dhaouadi, Lotfi Sellaoui, Sonia Taamalli, Florent Louis, Abderrahman El Bakali, Tito Roberto Sant'anna Cadaval Junior, Adrián Bonilla-Petriciolet, Jorge Luiz Marques Junior, Andrei VallerãoIgansi, Tuanny Santos Frantz, Sabrina Frantz lütke, Guilherme Luiz Dotto, Luiz Antonio De Almeida Pinto, Abdelmottaleb Ben Lamine, A statistical physics analysis of the adsorption of Fe3+, Al3+ and Cu2+ heavy metals on chitosan films via homogeneous and heterogeneous monolayer models, Journal of Molecular Liquids 343 (2021) 117617.

57. Fatma Aouaini, Lotfi Sellaoui, Meznah M. Alanazi, Guilherme L. Dotto, Wafa Alfwzan, Haifa A Al-Yousef, Alessandro Erto, Theoretical analysis of the removal mechanism of Crystal Violet and Acid Red 97 dyes on Agaricus bisporus residue, Journal of Molecular Liquids, 343 (2021) 117621.

58. Lotfi Sellaoui, Amira Yazidi, SoniaTaamalli, Adrián Bonilla-Petriciolet, Florent Louis, Abderrahman El Bakali, Michael Badawi, Eder C.Lima, Diana R.Lima, Zhuqi Chen, Adsorption of 3-aminophenol and resorcinol on avocado seed activated carbon: Mathematical modelling, thermodynamic study and description of adsorbent performance, Journal of Molecular Liquids 342 (2021) 116952.

59. Chesseu M.Darryle, Elie Acayanka, BriceTakam, Leundjeu N.Line, Georges Y. Kamgang, Samuel Laminsi, Lotfi Sellaoui, Adrián Bonilla-Petriciolet, Influence of plasma-based surface functionalization of palm fibers on the adsorption of diclofenac from water: Experiments, thermodynamics and removal mechanism, Journal of Water Process Engineering 43 (2021) 102251.

60. Manel BenYahia, Lotfi Sellaoui, Piaçava fibers as efficient material to remove a textile dye: Insights of the adsorption mechanism via advanced modelling, Journal of Molecular Liquids 340 (2021) 117090.

61. Beibei Wu, Jerosha Ifthikar, Daniel T.Oyekunle, Ali Jawad, Zhuqi Chen, Zhulei Chen, Lotfi Sellaoui, Mohamed Bouzid, Interpret the elimination behaviors of lead and vanadium from the water by employing functionalized biochars in diverse environmental conditions, Science of The Total Environment 789 (2021) 148031.

62. Jerosha Ifthikar, Mengmeng Zhao, Ajmal Shahzad, Irshad Ibran Shahib, Jia Wang, Huabin Wang, Lotfi Sellaoui, Zhuqi Chen, Zhulei Chenb, Recyclable process modeling study of hexavalent chromium elimination by thiol-based electron donor: Implications for practical applicability, Journal of Environmental Chemical Engineering 9 (2021) 105645.

63. Benamar Cheknane, Faïza Zermane, Omar Bouras, Jean Debord, Michel Hareld, Jean-Claude Bollinger, Lotfi Sellaoui, Adrián Bonilla-Petriciolet, Modeling of binary and ternary batch adsorption systems via multidimensional logistic distribution and statistical physics, Journal of Environmental Chemical Engineering 9 (2021) 105664.

64. Haifa A.Al-Yousef, Badriah M.Alotaibi, Fatma Aouaini, Lotfi Sellaoui, Adrian Bonilla-Petriciolet, Adsorption of ibuprofen on cocoa shell biomass-based adsorbents: Interpretation of the adsorption equilibrium via statistical physics theory, Journal of Molecular Liquids 331 (2021) 115697.

65. Lotfi Sellaoui, Fatma Dhaouadi, ZichaoLi, Tito R.S. Cadaval Jr, Andrei V. Igansi, Luiz A.A. Pinto, Guilherme L. Dotto, Adrian Bonilla-Petriciolet, Diana Pinto, Zhuqi Chen, Implementation of a multilayer statistical physics model to interpret the adsorption of food dyes on a chitosan film, Journal of Environmental Chemical Engineering 9 (2021) 105516.

66. Huifeng Wang, Zichao Li, Samia Yahyaoui, Hassan Hanafy, Moaaz K.Seliem, Adrian Bonilla-Petriciolet, Guilherme Luiz Dotto, Lotfi Sellaoui, Qun Lia, Effective adsorption of dyes on an activated carbon prepared from carboxymethyl cellulose: Experiments, characterization and advanced modelling, Chemical Engineering Journal 417 (2021) 128116.

67. Manel Touihri, Fatma Guesmi, Chiraz Hannachi, Béchir Hamrouni, Lotfi Sellaoui, Michael Badawi, Jordi Poch, Núria Fiol, Single and simultaneous adsorption of Cr(VI) and Cu (II) on a novel Fe3O4/pine cones gel beads nanocomposite: Experiments, characterization and isotherms modeling, Chemical Engineering Journal 416 (2021) 129101.

68. Fatma Dhaouadi, Lotfi Sellaoui, Brenda Chávez-González, Hilda Elizabeth Reynel-Ávila, Liliana Lizbeth Diaz-Muñoz, Didilia Ileana Mendoza-Castillo, Adrián Bonilla-Petriciolet, Eder C. Lima, Juan Carlos Tapia-Picazo, Abdelmottaleb Ben Lamine, Application of a heterogeneous physical model for the adsorption of Cd2+, Ni2+, Zn2+ and Cu2+ ions on flamboyant pods functionalized with citric acid, Chemical Engineering Journal 417 (2021) 127975.

69. Naim Bel Haj Mohamed, Mohamed Bouzidi, Nassim Ben brahim, Lotfi Sellaoui, Mohamed Haouari, Hatem Ezzaouia, Adrian Bonilla-Petriciolet, Impact of the stacking fault and surface defects states of colloidal CdSe nanocrystals on the removal of reactive black 5, Materials Science and Engineering: B 265 (2021) 115029.

70. Haifa A. Al-Yousef, Badriah.M. Alotaibi, Meznah M. Alanazi, Fatma Aouaini, Lotfi Sellaoui, Adrian Bonilla-Petriciolet,Theoretical assessment of the adsorption mechanism of ibuprofen, ampicillin, orange G and malachite green on a biomass functionalized with plasma, Journal of Environmental Chemical Engineering 9 (2021) 104950.

71. Almudena Gómez-Avilés, Lotfi Sellaoui, Michael Badawi, Adrián Bonilla-Petriciolet, Jorge Bedia, Carolina Belver, Simultaneous adsorption of acetaminophen, diclofenac and tetracycline by organo-sepiolite: Experiments and statistical physics modelling, Chemical Engineering Journal 404 (2021) 126601. 72. Ismahene Ben Khemis, Abdelmottaleb Ben Lamine, Physico-chemical investigations of human olfactory receptors OR10G4 and OR2B11 activated by vanillin, ethyl vanillin, coumarin and quinoline molecules using statistical physics method, International Journal of Biological Macromolecules 193 (2021) 915-922. 73. Ismahene Ben Khemis, Abir Sagaama, Noureddine Issaoui, Abdelmottaleb Ben Lamine, Steric and energetic characterizations of mouse and human musk receptors activated by nitro musk smelling compounds at molecular level: Statistical physics treatment and molecular docking analysis, International Journal of Biological Macromolecules, 188 (2021) 333-342.

74. Marwa Ben Manaa, Nuha Wazzan, Abdelmottaleb Ben Lamine, Physico-chemical interpretations of the adsorption isotherms of D–π–A sensitizers with pyridyl group on TiO2 for dye sensitized solar cells using statistical physics and density functional theory, Journal of Materials Research and Technology, 15 (2021) 369-383.

75. Ismahene Ben Khemis, Abdelmottaleb Ben Lamine, Adsorption of 2-phenylethanethiol on two broadly tuned human olfactory receptors OR1A1 and OR2W1: Interpretation of the effect of copper ions via statistical physics monolayer adsorption model, Journal of Molecular Liquids 341 (2021) 116926.

76. Amira Yazidi, Lotfi Sellaoui, Michael Badawi, Eder C.Lima, Adrián Bonilla-Petriciolet, Pascal S.Thue, Nilton F.G.M. Cimirro, Abdelmottaleb Ben Lamine, Physicochemical interpretation of the adsorption of 4-Bromophenol and 4-Chloroaniline on an activated carbon, Journal of Environmental Chemical Engineering 8 (2021) 104542.

77. Lotfi Sellaoui, Michael Badawi, Antonio Monari, Tetiana Tatarchukd, Sonia Jemli, Guilherme Luiz Dotto, Adrian Bonilla-Petriciolet, Zhuqi Chen, Make it clean, make it safe: A review on virus elimination via adsorption, Chemical Engineering Journal 412 (2021) 128682

78. Lotfi Sellaoui, Luis F.O. Silva, Michael Badawi, Jawad Ali, Nathália Favarin, Guilherme L. Dotto, Alessandro Erto, Zhuqi Chen, Adsorption of ketoprofen and 2- nitrophenol on activated carbon prepared from winery wastes: A combined experimental and theoretical study, Journal of Molecular Liquids 333 (2021) 115906

79. Lotfi Sellaoui, Etienne Paul Hessou, Michael Badawi, Matias Schadeck Netto, Guilherme Luiz Dotto, Luis Felip, Oliveira Silva, Frederik Tielens, Jerosha Ifthikar, Adrian Bonilla-Petriciolet, Zhuqi Chen, Trapping of Ag+, Cu2+, and Co2+ by faujasite zeolite Y: New interpretations of the adsorption mechanism via DFT and statistical modeling investigation, Chemical Engineering Journal 420 (2021) 127712

80. Fatma Aouini, Mohamed Ben Yahia, Meznah M. Alanazi, Phenomenological statistical physics modeling of metalloporphyrins adsorption at the molecular level, Journal of Molecular Liquids 340 (2021) 117108

81. Fatma Aouaini, Water vapor molecule adsorption onto 'Ajwa' dates: Analytical investigation via infinite multilayer statistical physics model, Arabian Journal of Chemistry 14 (2021) 103248.

82. Fatma Aouaini, Mohamed Ben Yahia, Haifa Alyousef, Badriah M. Alotaibi, Effective adsorption of metals on porphyrins: Experiments and advanced isotherms modeling, Arabian Journal of Chemistry 14 (2021) 103203.

83. Fatma Aouaini , Mohamed BenYahia, Haifa I.Alrebdi, Miysoon A. Alothman, Interpretation of the adsorption of metals on quartz crystal based‑macromolecule via advanced modeling of equilibrium isotherms, Scientifc Reports 11 (2021) 20031.

84. Zaineb Elqahtani, Mohamed Ben Yahia, Nada Alfryyan, Shatha Aldaghfaq, Fatma Aouaini, Statistical Physics Modeling of Sorption Isotherms of Aluminum, Iron, and Indium on Tetraphenylporphyrin (H2TPP) and Tetrakis (4-tolylphenyl) porphyrin (H2TTPP): Phenomenological Investigation of Metalloporphyrins at the Molecular Level, Adsorption Science & Technology (2021) 1-14.

85. Fatma Aouaini, Nadia Bouaziz, Maha M. Almoneef, Hanan Al-Ghamdi, Abdelmottaleb Ben Lamine, Absorption and desorption of hydrogen in Ti1.02Cr1.1Mn0.3Fe0.6RE0.03: experiments, characterization and analytical interpretation using statistical physics treatment, RSC Advances 11 (2021) 15905.

86. Mohamed Ben Yahia, Hanan Yahya Saeed Al Zahrani, Manel Ben Yahia, Application of advanced statistical physics modeling for the physicochemical analysis of adsorption isotherms of manganese (II) on porphyrins H2TPP and H2TTP, Brazilian Journal of Chemical Engineering 38 (2021) 373-383.

87. Marwa Atrous, Yosra Ben Torkia, Taher Selmi, Mohamed Bouzid, Mongi Seffen, Abdelmottaleb. Ben Lamine, Tetracycline Adsorption onto Agave Americana Activated Carbon: Studies of Physicochemical Parameters and Porous Structure 57 (2021) 297–302.

88. Hanjing Xue, Xuemei Wang, Qi Xu, Fatma Dhaouadi, Lotfi Sellaoui, Moaaz K. Seliem, Abdelmottaleb Ben Lamine, Hafedh Bel mabrouk, Abdullah Bajahzar, Adrian Bonilla-Petriciolet, Zichao Li, Qun Li, Adsorption of methylene blue from aqueous solution on activated carbons and composite prepared from an agricultural waste biomass: A comparative study by experimental and advanced modeling analysis, Chemical Engineering Journal (2021).

89. Muhamad Sharafee Shamsudin, Syahida Farhan Azha, Lotfi Sellaoui; Michael Badawi, Adrian Bonilla-Petriciolet, Suzylawati Ismail, Performance and interactions of diclofenac adsorption using Alginate/Carbon-based Films: Experimental investigation and statistical physics modelling, Chemical Engineering Journal (2021).

90. Zouhair Elkhlifi, Lotfi Sellaoui, Mengmeng Zhao, Jerosha Ifthikar, Ali Jawad, Irshad Ibran Shahib, Badreddine Sijilmassi, Altaf Hussain Lahori, Rangabhashiyam Selvasembian, Lucas Meili, Eman Abdelnasser Gendy, Zhuqi Chen, Lanthanum hydroxide engineered sewage sludge biochar for efficient phosphate elimination: Mechanism interpretation using physical modelling, Science of The Total Environment (2021).

1. Benali, M., M., Desnault, C., Mazouz, M. et al, Deeply virtual Compton scattering off the neutron. Nature Physics 16, 191-198 (2020).

2. Jemii, E., Mazouz. M., Measurement of Radioactivity in Carbonated Soft Drinks and Annual Dose Assessment, Journal of Environmental Protection 11 (9), 682-689 (2020).

3. Jemii, E., Screening level of Gross Alpha and Beta Activities in building materials, J. Chemistry 2020, 1741430 (2020).

4. Benali, M., Quéméner, G., Delahaye, P. et al, Geometry optimisation of a transparent axisymmetric ion trap for the MORA project. The European Physical Journal A 56. (2020).

5. K. Laajimi, M. Khlifi, E.K. Hlil, M.H. Gazzah, M. Ben Ayed, H. Belmabrouk, J. Dhahri, Influence of Sr substitution on structural, magnetic and magnetocaloricproperties in La 0.67 Ca 0.33−x Sr xMn 0.98 Ni 0.02 O 3 manganites, Journal: journal of materials science materials in electronics, 31,15322–15335(2020). A. Elkaroui, A. Amamou, R. Ben Khalifa, N. Mahjoub Saïd, M.H. Gazzah, M. Abd El-Rahman, Numerical predictions of near field behavior of variable density non-reacting turbulent round jets, International Journal of Heat and Mass Transfer, 2020, 160, 120201. A. El Aouami, M. Bikerouin, M. El-Yadri, E. Feddi, F. Dujardin, M. Courel, B. Chouchen, M.H. Gazzah, H. Belmabrouk, Internal polarization electric field effects on the efficiency of InN/InxGa1-xN multiple quantum dot solar cells, Solar Energy, 2020, 201, pp. 339–347.

6. X. Pang, M. Bouzid, J. M.N. dos Santos, M.H. Gazzah, G. Luiz Dottoc, H. Belmabroukd, A. Bajahzar, A. Erto, Z. Li, Theoretical study of indigotine blue dye adsorption on CoFe2O4/chitosanmagnetic composite via analytical model, Colloids and Surfaces A, 589 (2020) 124467.

7. H. Belmabrouk, B. Chouchen, E. Feddi, F. Dujardin, I. Tlili, M. Ben Ayed, M.H. Gazzah, Modeling the simultaneous effects of thermal and polarization in InGaN/GaN based high electron mobility transistors, Optik, 207 (163883) (2020) 1-8. A. Sagaama, O. Noureddine, S.A. Brandán, A. Jarczyk-Jędryka, H.T. Flakus, H. Ghalla, N. Issaoui, Molecular docking studies, structural and spectroscopic properties of monomeric and dimeric species of benzofuran-carboxylic acids derivatives: DFT calculations and biological activities, Comput. Biol. Chem. 87 (2020) 107311. B. Gassoumi, H. Ghalla, R. Ben. Chaabane, A theoretical study of the global and local electrophilicity, nucleophilicity, polarizability and QTAIM theory for calix[4]arene-gas interaction, Heliyon, 6 (2020) e04554.

8. M. Ghnimi, M. Mbarek, M. M. Almoneef, H. Ghalla, K. Alimi, Modeling of carbon nanospheres poly (9‑vinylcarbazole) composites interaction: effect of diameter, distance and CNSs number, Theo. Chem. Acc. (2020) 139:104.

9. Gassoumi, H. Ghalla, R. Ben Chaabane, Host-guest complexation studies of NO3, NO2, CO2, and N2 gas with the calix[4]arene molecule, J. Mol. Mod. (2020) 26:149.

10. L. Sellaoui, D. Franco, H. Ghalla, J. Georgin, M.S. Netto, G.L. Dotto, A. Bonilla-Petriciolet, H. Belmabrouk, A. Bajahzar, Insights of the adsorption mechanism of methylene blue on brazilian berries seeds: Experiments, phenomenological modelling and DFT calculations, Chem. Eng. J. 394 (2020) 125011.

11. M.B. Hadj Ayed, H. Ghalla, Solvation of lithium ion in helium clusters: Structural properties and relative stabilities, J. Mol. Graph. Model. 98 (2020) 107582.

12. N.M. Zúñiga-Muro, A. Bonilla-Petriciolet, D.I. Mendoza-Castillo, H.E. Reynel-Ávila, C.J. Duran-Valle, H. Ghalla, L. Sellaoui, Recovery of grape waste for the preparation of adsorbents for water treatment: Mercury removal, J. Environ. Chem. Eng. 8 (2020) 103738.

13. M. Laajimi, S. Mtiri, H. Ghalla, Structure and stability of sodium doped helium snowballs through DFT calculations, Theor. Chem. Acc. (2020) 139:40. B. Gassoumi, M. Chaabene, H. Ghalla, R.B. Chaabane, Role of hydrogen bonding interactions within of the conformational preferences of calix[n=4,6,8]arene: DFT and QTAIM analysis, J. Mol. Model. 26 (2020) 12.

14. Romani, D., Noureddine, O., Issaoui, N., Brandán, S.A. Properties and reactivities of niclosamide in different media, a potential antiviral to treatment of COVID-19 by using DFT calculations and molecular docking (2020) Biointerface Research in Applied Chemistry, 10 (6), pp. 7295-7328.

15. Karrouchi, K., Fettach, S., Jotani, M.M., Sagaama, A., Radi, S., Ghabbour, H.A., Mabkhot, Y.N., Himmi, B., El Abbes Faouzi, M., Issaoui, N. Synthesis, crystal structure, hirshfeld surface analysis, DFT calculations, anti-diabetic activity and molecular docking studies of (E)-N’-(5-bromo-2-hydroxybenzylidene) isonicotinohydrazide (2020) Journal of Molecular Structure, 1221, art. no. 128800, .

16. Sagaama, A., Issaoui, N. Design, molecular docking analysis of an anti-inflammatory drug, computational analysis and intermolecular interactions energy studies of 1-benzothiophene-2-carboxylic acid (2020) Computational Biology and Chemistry, 88, art. no. 107348, .

17. Jomaa, I., Noureddine, O., Gatfaoui, S., Issaoui, N., Roisnel, T., Marouani, H. Experimental, computational, and in silico analysis of (C8H14N2)2[CdCl6] compound (2020) Journal of Molecular Structure, 1213, art. no. 128186.

18. Sagaama, A., Brandan, S.A., Ben Issa, T., Issaoui, N. Searching potential antiviral candidates for the treatment of the 2019 novel coronavirus based on DFT calculations and molecular docking (2020) Heliyon, 6 (8), art. no. e04640.

19. Gatfaoui, S., Sagaama, A., Issaoui, N., Roisnel, T., Marouani, H. Synthesis, experimental, theoretical study and molecular docking of 1-ethylpiperazine-1,4-diium bis(nitrate) (2020) Solid State Sciences, 106, art. no. 106326.

20. Ben Manaa, M., Issaoui, N., Al-Ghamdi, Y.O., Belmabrouk, H., Ben Lamine, A. A microscopic and macroscopic investigation of the adsorption of N719 dye on ZnO nanopowders (ZNP) and ZnO nanorods (ZNR) for dye sensitized solar cells using statistical physics treatment and DFT simulation (2020) RSC Advances, 10 (46), pp. 27615-27632.

21. Akman, F., Issaoui, N., Kazachenko, A.S. Intermolecular hydrogen bond interactions in the thiourea/water complexes (Thio-(H2O)n) (n = 1, …, 5): X-ray, DFT, NBO, AIM, and RDG analyses (2020) Journal of Molecular Modeling, 26 (6), art. no. 161.

22. Ben Issa, T., Sagaama, A., Issaoui, N. Computational study of 3-thiophene acetic acid: Molecular docking, electronic and intermolecular interactions investigations (2020) Computational Biology and Chemistry, 86, art. no. 107268.

23. Tahenti, M., Gatfaoui, S., Issaoui, N., Roisnel, T., Marouani, H. A tetrachlorocobaltate(II) salt with 2-amino-5-picolinium: Synthesis, theoretical and experimental characterization (2020) Journal of Molecular Structure, 1207, art. no. 127781.

24. Noureddine, O., Gatfaoui, S., Brandan, S.A., Sagaama, A., Marouani, H., Issaoui, N. Experimental and DFT studies on the molecular structure, spectroscopic properties, and molecular docking of 4-phenylpiperazine-1-ium dihydrogen phosphate (2020) Journal of Molecular Structure, 1207, art. no. 127762.

25. Manaa, M.B., Issaoui, N., Bouaziz, N., Lamine, A.B. Combined statistical physics models and DFT theory to study the adsorption process of paprika dye on TiO2 for dye sensitized solar cells (2020) Journal of Materials Research and Technology, 9 (2), pp. 1175-1188.

26. Noureddine, O., Gatfaoui, S., Brandán, S.A., Marouani, H., Issaoui, N. Structural, docking and spectroscopic studies of a new piperazine derivative, 1-Phenylpiperazine-1,4-diium bis(hydrogen sulfate) (2020) Journal of Molecular Structure, 1202, art. no. 127351.

27. Alyousef Haifa, Souissi Hanen, Mouna Ben Hadj Ayed, Alsahhaf Maareb. ‘One and two electrons pseudo-potential investigation of the (FrCs)+ and FrCs systems’ Arab Journal of Basic and Applied Sciences, 2020, 27(1) 456–470.

28. Elida Romano, Noureddine Issaoui, María E. Manzur, Silvia Antonia Brandán, PROPERTIES AND MOLECULAR DOCKING OF ANTIVIRAL TO COVID 19 CHLOROQUINE COMBINING DFT CALCULATIONS WITH SQMFF APPROACH, International Journal of Current Advanced Research ISSN: O: 2319-6475, ISSN: P: 2319-6505 (2020).

29. H. Souissi, L. Mejrissi, H. Habli, M . Alsahhaf, B. Oujia, F. Xavier Gadéa, Ab initio diabatic and adiabatic calculations for francium hydride FrH. New Journal of Chemistry, 44, 5572-5587 (2020).

30. H. Habli, L. Mejrissi, S. Jellali, B. Oujia. Spectroscopic proprieties of the ground and the higher excited states of the KCs. Journal of Physics B: Atomic, Molecular and Optical Physics, 53, 235102 (2020).

31. H. Habli, S. Jellali, M. Safa, B. Oujia, Theoretical investigation of the van der Waals interaction in Ba0,+,2+He systems and the stability of Ba2+Hen clusters. Physica Scripta, 95, 065406 (2020).

32. Amira Yazidi, Lotfi Sellaoui Michael Badawi, Eder C. Lima Adrián Bonilla-Petriciolet Pascal S.Thue, Nilton F.G.M.Cimirro, Abdelmottaleb Ben Lamine. Physicochemical interpretation of the adsorption of 4-Bromophenol and 4-Chloroaniline on an activated carbon, Journal of Environmental Chemical Engineering 8 (2020) 104542,

33. Lotfi Sellaoui, Jawad Ali, Michael Badawi, Adrian Bonilla-Petriciolet, Zhuqi Chen. Understanding the adsorption mechanism of Ag+ and Hg2+ on functionalized layered double hydroxide via statistical physics modeling. Applied Clay Science 198 (2020) 105828,

34. Fatma Dhaouadi, Lotfi Sellaoui, Michael Badawi, Hilda Elizabeth Reynel-Ávila, Didilia Ileana Mendoza-Castillo, José Enrique Jaime-Leal, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine. Statistical physics interpretation of the adsorption mechanism of Pb2+, Cd2+ and Ni2+ on chicken feathers, Journal of Molecular Liquids 319 (2020) 114168.

35. Zichao Li, Lotfi Sellaoui, Saber Gueddida, Guilherme Luiz Dotto, Abdelmottaleb Ben Lamine, Adrian Bonilla-Petriciolet, Michael Badawi. Adsorption of methylene blue on silica nanoparticles: Modelling analysis of the adsorption mechanism via a double layer model, Journal of Molecular Liquids 319 (2020) 114348.

36. Jerosha Ifthikar, Irshad Ibran Shahib, Lotfi Sellaoui, Ali Jawad, Mengmeng Zhao, Zhuqi Chen, Zhulei Chen. pH tunable anionic and cationic heavy metal reduction coupled adsorption by thiol cross-linked composite: Physicochemical interpretations and fixed-bed column mathematical model study, Chemical Engineering Journal 401 (2020) 126041.

37. Lotfi Sellaoui, Zichao Li, Michael Badawi, Guilherme Luiz Dotto, Adrian Bonilla-Petriciolet, Zhuqi Chen. Origin of the outstanding performance of Zn-Al and Mg-Fe layered double hydroxides in the adsorption of 2-nitrophenol: A statistical physics assessmen, Journal of Molecular Liquids 314 (2020) 113572.

38. Lotfi Sellaoui, Huabin Wang, Michael Badawi, Adrian Bonilla-Petriciolet, Zhuqi Chen. Synergistic adsorption of Pb2+ and CrO42- on an engineered biochar highlighted by statistical physical modeling, Journal of Molecular Liquids 312 (2020) 113483.

39. Muhamad Sharafee Shamsudin, Syahida Farhan Azha, Lotfi Sellaoui, Michael Badawi, Youssef O. Al-Ghamdi, Adrian Bonilla-Petriciolet, Suzylawati Ismail. Fabrication and characterization of a thin coated adsorbent for antibiotic and analgesic adsorption: Experimental investigation and statistical physical modelling, Chemical Engineering Journal 401 (2020) 126007.

40. Shazlina Abd Hamid, Syahida Farhan Azha, Lotfi Sellaoui, Adrian Bonilla-Petriciolet, Suzylawati Ismail. Adsorption of copper (II) cation on polysulfone/zeolite blend sheet membrane: Synthesis, characterization, experiments and adsorption modelling, Colloids and Surfaces A: Physicochemical and Engineering Aspects 601 (2020) 124980.

41. Amira Yazidi, Lotfi Sellaoui, Michael Badawi, Guilherme Luiz Dotto, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Alessandro Erto. Ternary adsorption of cobalt, nickel and methylene blue on a modified chitin: Phenomenological modeling and physical interpretation of the adsorption mechanism, International Journal of Biological Macromolecules 158 (2020) 595-604.

42. Fatma Dhaouadi, Lotfi Sellaoui, Guilherme Luiz Dotto, Adrián Bonilla-Petriciolet, Alessandro Erto, Abdelmottaleb Ben Lamine. Adsorption of methylene blue on comminuted raw avocado seeds: Interpretation of the effect of salts via physical monolayer model, Journal of Molecular Liquids 305 (2020) 112815.

43. Manel Ben Yahia, Lotfi Sellaoui. Adsorptive removal of sunset yellow dye by biopolymers functionalized with (3–aminopropyltriethoxysilane): Analytical investigation via advanced model, Journal of Molecular Liquids 312 (2020) 113395.

44. Younes Dehmani, Lotfi Sellaoui, Youssef Alghamdi, Juliette Lainé, Michael Badawi, Abdellatif Amhoud, A.Bonilla-Petriciolet, Taibi Lamhasni, Sadik Abouarnadasse. Kinetic, thermodynamic and mechanism study of the adsorption of phenol on Moroccan clay, Journal of Molecular Liquids 312 (2020) 113383,

45. Lotfi Sellaoui, Dison Franco, Houcine Ghalla, Jordana Georgin, Matias S.Netto, Guilherme Luiz Dotto, Adrian Bonilla-Petriciolet, Hafedh Belmabrouk, Abdullah Bajahzar. Insights of the adsorption mechanism of methylene blue on brazilian berries seeds: Experiments, phenomenological modelling and DFT calculations, Chemical Engineering Journal 394 (2020) 125011.

46. Ioannis Anastopoulos, Ioannis Pashalidis, Alexios G.Orfanos, Ioannis D.Manariotis, Tetiana Tatarchuk, Lotfi Sellaoui, Adrián Bonilla-Petriciolet, Alok Mittal, Avelino Núñez-Delgado. Removal of caffeine, nicotine and amoxicillin from (waste) waters by various adsorbents. A review, Journal of Environmental Management 261 (2020) 110236.

47. Zichao Li, Lotfi Sellaoui, Dison Franco, Matias Schadeck Netto, Jordana Georgin, Guilherme Luiz Dotto, Abdullah Bajahzar, Hafedh Belmabrouk, Adrian Bonilla-Petriciolet, Qun Li. Adsorption of hazardous dyes on functionalized multiwalled carbon nanotubes in single and binary systems: Experimental study and physicochemical interpretation of the adsorption mechanism, Chemical Engineering Journal 389 (2020) 124467.

48. Zichao Li, Hassan Hanafy, Lei Zhang, Lotfi Sellaoui, Matias Schadeck Netto, Marcos L.S.Oliveira, Moaaz K.Seliem, Guilherme Luiz Dotto, Adrian Bonilla-Petriciolet, Qun Li. Adsorption of congo red and methylene blue dyes on an ashitaba waste and a walnut shell-based activated carbon from aqueous solutions: Experiments, characterization and physical interpretations, Chemical Engineering Journal 388 (2020) 124263.

49. Xuening Pang, Lotfi Sellaoui, Dison Franco, Matias S.Netto, Jordana Georgin, Guilherme Luiz Dotto, Mohammad K.Abu Shayeb, Hafedh Belmabrouk, Adrian.Bonilla-Petriciolet, Zicha Li. Preparation and characterization of a novel mountain soursop seeds powder adsorbent and its application for the removal of crystal violet and methylene blue from aqueous solutions, Chemical Engineering Journal 391 (2020) 123617.

50. Pollyanna Vaness, Santos Lins, Daniely Carlos Henrique, Alessandra Honjo Ide, José Leandro da silva Duarte, Guilherme Luiz Dotto, Amira Yazidi, Lotfi Sellaoui, Alessandro Erto, Carmem Lucia de Paiva e SilvaZanta, Lucas Meili. Adsorption of a non-steroidal anti-inflammatory drug onto MgAl/LDH-activated carbon composite – Experimental investigation and statistical physics modeling, Colloids and Surfaces A: Physicochemical and Engineering Aspects 586 (2020) 124217.

51. Puyue Hua, Lotfi Sellaoui, Dison Franco, Matias S.Netto, Guilherme Luiz Dotto, Abdullah Bajahzar, Hafedh Belmabrouk, A.Bonilla-Petriciolet, Zichao Li. Adsorption of acid green and procion red on a magnetic geopolymer based adsorbent: Experiments, characterization and theoretical treatment, Chemical Engineering Journal 383 (2020) 123113.

52. Hassan Hanafy, Lotfi Sellaoui, Pascal Silas Thue, Eder C.Lima, Guilherme L.Dotto, Thamer Alharbi, Hafedh Belmabrouk, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine. Statistical physics modeling and interpretation of the adsorption of dye remazol black B on natural and carbonized biomasses, Journal of Molecular Liquids 299 (2020) 112099.

53. Lei Zhang, Lotfi Sellaoui, Dison Franco, Guilherme Luiz Dotto, Abdullah Bajahzar, Hafedh Belmabrouk, A.Bonilla-Petriciolet, Marcos L.S.Oliveira, Zichao Li. Adsorption of dyes brilliant blue, sunset yellow and tartrazine from aqueous solution on chitosan: Analytical interpretation via multilayer statistical physics model, Chemical Engineering Journal 382 (2020) 122952.

54. Amira Yazidi, Marwa Atrous, Felycia Edi Soetaredjo, Lotfi Sellaoui, Suryadi Ismadji, Alessandro Erto, Adrián Bonilla-Petriciolet, Guilherme Luiz Dotto, Abdelmottaleb Ben Lamine. Adsorption of amoxicillin and tetracycline on activated carbon prepared from durian shell in single and binary systems: Experimental study and modeling analysis, Chemical Engineering Journal 379 (2020) 122320.

55. Essam A.Mohamed, Ali Q.Selim, Sayed A.Ahmed, Lotfi Sellaoui, Adrián Bonilla-Petriciolet, Alessandro Erto, Zichao Li, Yanhui Li, Moaaz K.Seliem. H2O2-activated anthracite impregnated with chitosan as a novel composite for Cr(VI) and methyl orange adsorption in single-compound and binary systems: Modeling and mechanism interpretation, Chemical Engineering Journal 380 (2020) 122445.

56. Sarra Wjihi, Fatma Aouaini, Aljawhara H.Almuqrin, Abdelmottaleb Ben Lamine. Physicochemical assessment of prednisone adsorption on two molecular composites using statistical physics formalism in cosmetics, Arabian Journal of Chemistry 13 (2020) 6876-6886.

57. Aljawhara H.Almuqrin, Sarra Wjihi, Fatma Aouaini, Abdelmottaleb Ben Lamine. New insights on physico-chemical investigation of bisphosphonate adsorption isotherm into apatite substrate using statistical physics treatment, Journal of Molecular Liquids 310 (2020) 113230.

58. Marwa Ben Mana, Noureddine Issaoui, NadiaBouaziz Abdelmottaleb Ben Lamine. Combined statistical physics models and DFT theory to study the adsorption process of paprika dye On TiO2 for dye sensitized solar cells, Journal of Materials Research and Technology 9 (2020) 1175-1188.

59. Amel Nakbi, Mohamed Bouzid, Fakher Ayachi, Nadia Bouaziz, Abdelmottaleb Ben Lamine. Quantitative characterization of sucrose taste by statistical physics modeling parameters using an analogy between an experimental physicochemical isotherm of sucrose adsorption on β-cyclodextrin and a putative biological sucrose adsorption from sucrose dose-taste response curve (psychophysics and electrophysiology), Journal of Molecular Liquids 298 (2020) 111950.

60. Ismahene Ben Khemis, Nesrine Mechi, Abdelmottaleb Ben Lamine. Investigation of mouse eugenol olfactory receptor activated by eugenol, vanillin and ethyl vanillin: Steric and energetic characterizations, International Journal of Biological Macromolecules 163 (2020) 2325-2333.

61. Yahia, M. B., & Yahia, M. B. Physico-chemical study of complexation of silver ion (Ag+) by macrocyclic molecules (hexa-Helicenes) based on statistical physics theory: new description of a cancer drug. Scientific Reports, 10(1), (2020). 1-13.

62. Yahia, M. B., & Yahia, M. B. (2020). New insights in the physicochemical investigation of the vitamin B 12 nucleus using statistical physics treatment: interpretation of experiments and surface properties. RSC Advances, 10(37), 21724-21735.

63. Alyousef, H., Yahia, M. B., & Aouaini, FStatistical physics modeling of water vapor adsorption isotherm into kernels of dates: Experiments, microscopic interpretation and thermodynamic functions evaluation. Arabian Journal of Chemistry, . (2020). 13(3), 4691-4702.

64. Alyousef, H., Aouaini, F., & Yahia, M. B. (New insights on physico-chemical investigation of water adsorption isotherm into seed of dates using statistical physics treatment: Pore size and energy distributions. Journal of Molecular Liquids2020)., 298, 112041.

65. Pang, X., Mohamed Bouzid, dos Santos, J. M., hichem Gazzah, M., Dotto, G. L., Belmabrouk, H., & Li, Z. Theoretical study of indigotine blue dye adsorption on CoFe2O4/chitosan magnetic composite via analytical model. Colloids and Surfaces A: Physicochemical and Engineering Aspects, (2020).589, 124467.

66. Abdullah Bajahzar., Mohamed Bouzid., Chaker Briki., Faouzi Nasri., Hafedh Belmabrouk., & Abdelmajid Jemni. Experimental and numerical study of the isotherms and determination of physicochemical parameters of the hydrogen absorption/desorption process by the metal hydrides. International Journal of Hydrogen Energy, 45(30), (2020). 15281-15293.

67. Salah Knani, Najla Khalifa, Mohamed Ben Yahia, Fatma Aouaini, Moncef Tounsi, Statistical physics study of the interaction of the 5, 10, 15, 20-tetrakis (4-tolylphenyl) porphyrin (H2TTPP) with magnesium ion: New microscopic interpretations, Arabian Journal of Chemistry 13 (2020) 4374-4385.

68. Nadia Bouaziz, Marwa Ben Manaa, Mohamed Bouzid, Abdelmottaleb Ben Lamine, Adsorption of hydrogen in defective carbon nanotube: modelling and consequent investigations using statistical physics formalism, Molecular Physics 118 (2019) 1-13.

69. Entesar Sulaiman Almogait, Mohamed Ben Yahia, Hanan Al-Ghamdi, Aljawharah Hamad Almuqrin, Advanced statistical physics modeling of a chiral molecular tweezer of silver ion: Microscopic investigation of adsorption of silver(I) on hexahelicene and heptahelicene, AIP Advances 10 (2020) 105229.

1. S. Blel, Ajmi B.H Hamouda, Results in Physics 12 (2019) 1475-1480.

2. S. Blel, Ajmi B.H Hamouda, Physica A 524 (2019) 112-120, “Surface morphology and a dynamic scaling analysis in epitaxial growth: A Kinetic Monte Carlo Study”

3. C. Bilel, S. Blel, Ajmi B.H Hamouda, Results in Physics 15 (2019) 102638 “Formation of Fe nanowires on Cu(1 0 0) vicinal surfaces”

4. J. Bericic, L. Correa, M. Benali et al, New Insight in the Q2-Dependence of Proton Generalized Polarizabilities, Phys.Rev.Lett. 123 no.19, 192302 (2019).

5. Blomberg et al. [including Benali M.], Virtual Compton scattering measurements in the nucleon resonance region. The European Physical Journal A 55, 182 (2019).

6. Delahaye, P., Liénard, E., Moore, I.,Benali, M. et al, The MORA project. Hyperfine Interactions, 240, Article 63. (2019).

7. Delahaye, P., Ban, G., Benali, M. et al, The open LPC Paul trap for precision measurements in beta decay. The European Physical Journal A 55, 101 (2019).

8. Roy, P. et al. [including Fradi A.], First Measurements of the Double-Polarization Observables and in Photoproduction off Transversely Polarized Protons in the Resonance Region, Physical review letters 122 (16), 162301 (2019).

9. Hattawy, M. et al. [including Fradi A.], Exploring the structure of the bound proton with deeply virtual Compton scattering, Physical review letters 123 (3), 032502 (2019).

10. Jalel Mhalla, Sondes Boughammoura, Anis Ghazouani, Some New Contributions to the Theory of Polyelectrolyte Solutions: Prediction of Polyion Conformation and Interpretation of Some Deviations from Kohlrausch’s Law According to the Superposition Principle and the Dielectric Friction Effect, Journal of Solution Chemistry 48(11)- December 2019.

11. H. Chtioui, K. Bouchlaghem, M.H. Gazzah, Identification and assessment of intense African dust events and contribution to PM10 concentration in Tunisia, Eur. Phys. J. Plus, (2019) 134: 575.

12. Chouchen, A. El Aouami, M.H. Gazzah, A. Bajahzar, E. Feddi, F. Dujardin, H. Belmabrouk, Modeling the impact of temperature effect and polarization phenomenon on InGaN/GaN-Multi-quantum well solar cells, Optik, 199, 163385 (2019) 1-8.

13. K. Laajimi, M. Khlifi, E.K. Hlil, M.H. Gazzah, J. Dhahri, Enhancement of magnetocaloric effect by Nickel substitution in La0.67Ca0.33Mn0.98Ni0.02O3 manganite oxide, Journal of Magnetism and Magnetic Materials, 24, July 2019, 165625.

14. Y. Saad, M. Selmi, M.H Gazzah, H. Belmabrouk, Performance enhancement of a copper-based optical fiber SPR sensor by the addition of an oxide layer, Optik, 190 (2019) 1-9.

15. K. Laajimi, M. Khlifi, E.K. Hlil, K. Taibi, M.H. Gazzah, J. Dhahri, Room temperature magnetocaloric effect and critical behavior in La0.67Ca0.23Sr0.1Mn0.98Ni0.02O3 oxide, J Mater Sci: Mater Electron, (2019) 30: 11868.

16. Chouchen, M.H Gazzah, A. Bajahzar, H. Belmabrouk, Numerical modeling of InGaN/GaN p-i-n solar cells under temperature and hydrostatic pressure effects, AIP Advances, 9, 045313 (2019).

17. B. Chouchen, M.H Gazzah, A. Bajahzar, H. Belmabrouk, Numerical modeling of the electronic and electrical characteristics of InGaN/GaN-MQW solar cells, Materials, 2019, Apr; 12 (8): 1241.

18. M.H Gazzah, B. Chouchen, A.Fargi, H. Belmabrouk, Electro-thermal modeling for InxGa1-xN/GaN based quantum well heterostructures, Materials Science in Semiconductor Processing, 2019, 93, pp. 231-237.

19. Sayer, N. Dege, H. Ghalla, A. Moliterni, H. Naïli, Crystal structure, DFT studies and thermal characterization of new luminescent stannate (IV) based inorganic-organic hybrid compound, J. Mol. Struct. 1224 (2019) 129266.

20. S. Mtiri, M. Laajimi, H. Ghalla, B. Oujia, Microsolvation of Ca2+ cation in small Xen clusters: Structures and relative stabilities, Physica B: Condensed Matter 578 (2020) 411849.

21. B. Gassoumi, H. Ghalla, R.B. Chaabane, DFT and TD-DFT investigation of calix[4]arene interactions with TFSI− ion, Heliyon, 5 (2019) 02822.

22. B. Hamdi, A. Jellali, N. Karâa, H. Ghalla, Synthesis, characterization, DFT calculations, electric and dielectric properties of (C6H10(NH3)2) CdCl4 H2O organic-inorganic hybrid compound, J. Mol. Struct. 1198 (2019) 126887.

23. M. Ben Hadj Ayed, T. Osmani, N. Issaoui, A. Berisha, B. Oujia, H. Ghalla, Structures and relative stabilities of Na+Nen (n=1-16) clusters via pairwise and DFT calculations, Theor. Chem. Acc. (2019) 138:84.

24. B. Gassoumi, M. Chaabene, H. Ghalla, R. Ben Chaabane, Physicochemical properties of the three-cavity form of calix[n=4,6,8] aren molecules: DFT investigation, Theor. Chem. Acc. (2019) 138: 58.

25. L. Sellaoui, D.I. Mendoza-Castillo, H.E. Reynel-Ávila, B.A. Ávila-Camacho, L.L. Díaz-Muñoz, H. Ghalla, A. Bonilla-Petriciolet, A. Ben Lamine. Understanding the adsorption of Pb2+,Hg2+ and Zn2+ from aqueous solution on a lignocellulosic biomass char using advanced statistical physics models and density functional theory simulations, Chem. Eng. J. 365 (2019) 305-316.

26. T. Ben Issa, F. Sayari, H. Ghalla, L. Benhamada, Synthesis, crystal structure, DFT calculations and molecular docking of L-pyroglutamic acid, J. Mol. Struct. 1178 (2019) 436-449.

27. K. Abdessalem, L. Mejrissi, H. Habli, N. Issaoui, H. Ghalla, B. Oujia. Spectroscopic and electric dipole properties of the Van der Waals interaction between barium and krypton atoms, Mol. Phys. 117 (2019) 143-157.

28. Safa Mtiri, Brahim Oujia, Spectroscopic, Vibrational and Structural properties analysis of CaXen (n=1-4) clusters, Comput. Theo.Chem. 2019, 1151, pp. 58–71.

29. Mansour, M., Issa, T.B., Issaoui, N., Harchani, A., Puebla, E.G., Ayed, B. Synthesis, crystal structure, vibrational spectroscopy, optical investigation and DFT study of a novel hybrid material: 4,4′-diammoniumdiphenylsulfone iodobusmuthate (2019) Journal of Molecular Structure, 1197, pp. 478-486.

30. Athmani, A.S., Madi, F., Laafifi, I., Cheriet, M., Issaoui, N., Nouar, L., Merdes, R. DFT Investigation of a Charge-Transfer Complex Formation Between p-Phenylenediamine and 3,5-Dinitrosalicylic Acid (2019) Journal of Structural Chemistry, 60 (12), pp. 1906-1916.

31. Gatfaoui, S., Issaoui, N., Roisnel, T., Marouani, H. A proton transfer compound template phenylethylamine: Synthesis, a collective experimental and theoretical investigations (2019) Journal of Molecular Structure, 1191, pp. 183-196.

32. Trabelsi, S., Issaoui, N., Brandán, S.A., Bardak, F., Roisnel, T., Atac, A., Marouani, H. Synthesis and physic-chemical properties of a novel chromate compound with potential biological applications, bis(2-phenylethylammonium) chromate(VI) (2019) Journal of Molecular Structure, 1185, pp. 168-182.

33. Rayes, A., Mezzadri, F., Issaoui, N., Ayed, B., Calestani, G. Synthesis, physico-chemical studies, non-linear optical properties and DFT calculations of a new non-centrosymmetric compound: (3-ammoniumpyridinium)tetrachloridozincate (II) (2019) Journal of Molecular Structure, 1184, pp. 524-531.

34. S. Jellali, H. Habli, L. Mejrissi, B. Oujia, F. X. Gadéa. Adiabatic and Diabatic Investigation of Numerous Electronic States for the Alkali Dimer FrNa. Journal of Physical Chemistry A, 123, 544-555 (2019).

35. Fakher Ayachi, George Z. Kyzas, Marwa Aatrous, Abdellatif Sakly, Abdelmottaleb Ben Lamine, Evaluating the adsorption of Ni(II) and Cu(II) on spirulina biomass by statistical physics formalism, Journal of Industrial and Engineering Chemistry 25 (2019) 461-470,

36. Marwa Atrous, Lotfi Sellaoui, Mohamed Bouzid, Eder C. Lima, Pascal Silas Thue,A. Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Adsorption of dyes acid red 1 and acid green 25 on grafted clay: Modeling and statistical physics interpretation, Journal of Molecular Liquids 294 (2019) 111610,

37. Ali Q. Selim, Lotfi Sellaoui, Sayed A. Ahmed, Mohamed Mobarak, Essam A. Mohamed, Abdelmottaleb Ben Lamine, Alessandro Erto, Adrián Bonilla-Petriciolet, Moaaz K. Seliem, Statistical physics-based analysis of the adsorption of Cu2+ and Zn2+ onto synthetic cancrinite in single-compound and binary systems, Journal of Environmental Chemical Engineering 7 (2019) 103217,

38. Xuening Pang, Lotfi Sellaoui, Dison Franco, Guilherme Luiz Dotto, Jordana Georgin, Abdullah Bajahzar, Hafedh Belmabrouk, Abdelmottaleb Ben Lamine, A. Bonilla-Petriciolet, Zichao Li, Adsorption of crystal violet on biomasses from pecan nutshell, para chestnut husk, araucaria bark and palm cactus: Experimental study and theoretical modeling via monolayer and double layer statistical physics models, Chemical Engineering Journal 378 (2019) 122101.

39. Yosra Ben Torkia, Marwa Atrous, Mohamed Bouzid, Guilherme Luiz Dotto, Abdelmottaleb Ben Lamine, Stereographic and energetic studies of acid blue 9 adsorption onto Spirulina platensis (strain LEB-52) based on statistical physics approach, Chemical Engineering Communications 207 (2019) 445-457,

40. Zichao Li, Guilherme Luiz Dotto, Abdullah Bajahzarc, Lotfi Sellaouid, Hafedh Belmabrouk , Abdelmottaleb Ben Lamine, A. Bonilla-Petriciolet, Adsorption of indium (III) from aqueous solution on raw, ultrasound- and supercritical-modified chitin: Experimental and theoretical analysis, Chemical Engineering Journal 373 (2019) 1247-1253,

41. Mohamed Ben Yahia, Manel Ben Yahia, Fatma Aouaini, Salah Knani , Hanan Al-Ghamdi, Entesar Sulaiman Almogait, Abdelmottaleb Ben Lamine, Adsorption of sodium and lithium ions onto helicenes molecules: Experiments and phenomenological modeling, Journal of Molecular Liquids 288 (2019) 110998,

42. Zichao Li, Lotfi Sellaoui, Guilherme Luiz Dotto, Abdelmottaleb Ben Lamine, A. Bonilla-Petriciolet, Hassan Hanafy, Hafedh Belmabrouk, Matias Schadeck Netto, Alessandro Erto, Interpretation of the adsorption mechanism of Reactive Black 5 and Ponceau 4R dyes on chitosan/polyamide nanofibers via advanced statistical physics model, Journal of Molecular Liquids 285 (2019) 165–170,

43. Hassan Hanafy, Lotfi Sellaoui, Pascal Silas Thue, Eder C. Lima, Guilherme L. Dotto, Thamer Alharbi, Hafedh Belmabrouk, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Statistical physics modeling and interpretation of the adsorption of dye remazol black B on natural and carbonized biomasses, Journal of Molecular Liquids (2019),

44. Zichao Li, Lotfi Sellaoui, Guilherme Luiz Dotto, A. Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Understanding the adsorption mechanism of phenol and 2-nitrophenol on a biopolymer-based biochar in single and binary systems via advanced modeling analysis, Chemical Engineering Journal 371 (2019) 1–6,

45. Amira Yazidi, Lotfi Sellaoui ,Guilherme L. Dotto, Adrián Bonilla-Petriciolet, Andressa Cristiana Fröhlich, Abdelmottaleb Ben Lamine, Monolayer and multilayer adsorption of pharmaceuticals on activated carbon: Application of advanced statistical physics models, Journal of Molecular Liquids 283 (2019) 276–286,

46. Mohamed Mobarak, Essam A. Mohamed, Ali Q. Selim, Lotfi Sellaoui, Abdelmottaleb Ben Lamine, Alessandro Erto, Adrián Bonilla-Petriciolet, Moaaz K. Seliem, Surfactant–modified serpentine for fluoride and Cr(VI) adsorption in single and binary systems: Experimental studies and theoretical modeling, Chemical Engineering Journal 369 (2019) 333–343,

47. Mohamed Bouzid, Nadia Bouaziz, Yosra Ben Torkia, Abdelmottaleb Ben Lamine, Statistical physics modeling of ethanol adsorption onto the phenol resin based adsorbents: Stereographic, energetic and thermodynamic investigations, Journal of Molecular Liquids 283 (2019) 674–687,

48. Zichao Li, A. Gómez-Avilés, Lotfi Sellaoui, Jorge Bedia, Adrián Bonilla-Petriciolet, Carolina Belver, Adsorption of ibuprofen on organo-sepiolite and on zeolite/sepiolite heterostructure: Synthesis, characterization and statistical physics modeling, Chemical Engineering Journal 371 (2019) 868–875,

49. Mohamed Mobarak, Essam A. Mohamed , Ali Q. Selim, F.M. Mohamed, Lotfi Sellaoui, Adrián Bonilla-Petriciolet, Moaaz K. Seliem, Statistical physics modeling and interpretation of methyl orange adsorption on high–order mesoporous composite of MCM–48 silica with treated rice husk, Journal of Molecular Liquids 285 (2019) 678–687,

50. Lotfi Sellaoui, D.I. Mendoza-Castillo, H.E. Reynel-Ávila, B.A. Ávila-Camacho, L.L. Díaz-Muñoz, Houcine Ghalla, A. Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Understanding the adsorption of Pb2+, Hg2+ and Zn2+ from aqueous solution on a lignocellulosic biomass char using advanced statistical physics models and density functional theory simulations, Chemical Engineering Journal 365 (2019) 305-316,

51. Syahida Farhan Azha, Lotfi Sellaoui, Engku Hafzanurudin Engku Yunus, Chew Jian Yee, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Suzylawati Ismai, Iron-Modified Composite Adsorbent Coating for Azo dye Removal and Its Regeneration by photo-Fenton Process: Synthesis, characterization and adsorption mechanism interpretation, Chemical Engineering Journal 361 (2019) 31-40,

52. Nesrine Mechi, Ismahene Ben Khemis, Guilherme Luiz Dotto, Dison Franco, Lotfi Sellaoui, Abdelmottaleb Ben Lamine, Investigation of the adsorption mechanism of methylene blue (MB) on Cortaderiaselloana flower spikes (FSs) and on Cortaderiaselloana flower spikes derived carbon fibers (CFs), Journal of molecular liquids 280 (2019) 268-273,

53. SarraWjihi, Enrique Chaves Peres, Guilherme Luiz Dotto, Abdelmottaleb Ben Lamine, Physicochemical assessment of crystal violet adsorption on nanosilica through the infinity multilayer model and sites energy distribution, Journal of molecular liquids 280 (2019) 58-63,

54. Nadia Bouaziz, Yosra Ben Torkia, Fatma Aouaini, Amal Nakbi, Houcine Dhaou, Abdelmottaleb Ben Lamine, Statistical physics modeling of hydrogen absorption onto LaNi4.6Al0.4: Stereographic and energetic interpretations, Separation Science and Technology 54 (2019) 1-20,

55. Fakher Ayachi, Amel Nakbi, Abdellatif Sakly, Luiz A.A. Pinto, Abdelmottaleb Ben Lamine, Application of statistical physics formalism for the modeling of adsorption isotherms of water molecules on the microalgae spirulina platensis, Food and Bioproducts Processing 114 (2019) 103-112,

56. Lotfi Sellaoui, Mouna Kehili, Eder Claudio Lima, Pascal S. Thue, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Guilherme L. Dotto, Alessandro Erto , Adsorption of phenol on microwave-assisted activated carbons: Modelling and interpretation, Journal of molecular liquids 274 (2019) 309-314,

57. Nadia Bouaziz, Marwa Ben Manaa, FatmaAouaini, Abdelmottaleb Ben Lamine, Investigation of hydrogen adsorption on zeolites A, X and Y using statistical physics formalism, Materials Chemistry and Physics 225 (2019) 111-121,

58. Mohamed Ben Yahia, Fatma Aouaini, Manel Ben Yahia, Entesar Sulaiman Almogait, Hanan Al-Ghamdi, Theoretical investigation of the chlorophyll nucleus adsorption monitored with Quartz Crystal Microbalance technique: New insights on physicochemical properties, Journal of Molecular Liquids 289 (2019) 111188,

59. Lotfi Sellaoui, D.I. Mendoza-Castillo, H.E. Reynel-Ávila, B.A. Ávila-Camacho, L.L. Díaz-Muñoz, Houcine Ghalla, A. Bonilla-Petriciolet, Abdelmottaleb Ben Lamine. Understanding the adsorption of Pb2+,Hg2+ and Zn2+ from aqueous solution on a lignocellulosic biomass char using advanced statistical physics models and density functional theory simulations, Chem. Eng. J. 365 (2019) 305–316.

1. S. Blel, Ajmi B.H Hamouda, Formation of Ag and Co Nanowires at the step of Cu(100) vicinal surfaces: A Kinetic Monte Carlo Study, VACCUM 151 (2018) 133-139.

2. El Mestikou, R., Jemii, E., Mazouz, M., Benali M., Ghédira L. Determination of the activity level in powdered milk available in Tunisia and assessment of the radiological risks, J. Radio. and Nucl. Chem., 317(2) 991 (2018).

3. Jemii, E., Alharbi, T., Measurements of natural radioactivity in infant formula and radiological risk assessment, J. Radio. and Nucl. Chem. 315(2), 157 (2018).

4. Saylor, N.H. et al. [including Fradi A.], Measurement of unpolarized and polarized cross sections for deeply virtual Compton scattering on the proton at Jefferson Laboratory with CLAS, Physical Review C 98 (4), 045203 (2018).

5. Ho, D.H. et al. [including Fradi A.], Beam-target helicity asymmetry e in KO Λ and KO Σ0 photoproduction on the neutron, Physical Review C 98(4), 045205 (2018).

6. Kunkel, M.C. et al. [including Fradi A.], Exclusive photoproduction of π0 up to large values of Mandelstam variables s t and u with CLAS, Physical Review C 98(1), 015207 (2018).

7. Bono, J. et al. [including Fradi A.], First measurement of Ξ− polarization in photoproduction, Physics Letters B 783, 280-286 (2018).

8. Roy, P. et al. [including Fradi A.], Measurement of the beam asymmetry and the target asymmetry in the photoproduction of mesons off the proton using CLAS at Jefferson Laboratory, Physical Review C 97 (5), 055202 (2018).

9. Jawalkar, S. et al. [including Fradi A.], Semi-inclusive π0 target and beam-target asymmetries from 6 GeV electron scattering with CLAS, Physics Letters B 782, 662 (2018).

10. Chandavar, S. et al. [including Fradi A.], Double KS0 photoproduction off the proton at CLAS, Physical Review C 97(2), 025203 (2018).

11. Elkaroui, S.B.H. Ayech, M.H. Gazzah, N. Mahjoub Saïd, G. Le Palec, Numerical study of local entropy generation in a heated turbulent plane jet developing in a co-flowing stream, Applied Mathematical Modelling, Volume 62, 2018, Pages 605-628.

12. Y. Saad, M. Selmi, M.H Gazzah, H. Belmabrouk , Theoretical evaluation of a fiber-optic SPR biosensor based on a gold layer treated with thiol acid, Eur. Phys. J. Appl. Phys, 2018, 82(3),31201.

13. Elkaroui, M.H. Gazzah, N. Mahjoub Saïd, P. Bournot, G. Le Palec, Entropy generation concept for a turbulent plane jet with variable density, Computers & Fluids, Volume 168, 30, 2018, P. 328-341.

14. M. Ben Hadj Ayed, R. Hamdi, H. Ghalla, B. Oujia, F. X. Gadéa, Theoretical investigation of the electronic properties of alkali atoms interacting with helium rare gas using a pseudopotential approach. Theo. Chem. Acc. (2018) 137:83.

15. H. Ghalla, N. Issaoui, F. Bardak, A. Atac, Intermolecular interactions and molecular docking investigations on 4-methoxybenzaldehyde, Comput. Mat. Sci. 149 (2018) 291-300.

16. T. Ben Issa, C. Ben Ali Hassine, H. Ghalla, H. Barhoumi, L. Benhamada, Experimental and computational study of electronic, electrochemical and thermal properties of quinoline phosphate, J. Mol. Struct. 1162 (2018) 71-80.

17. Florent Calvo, Rafika Hamdi, Leila Mejrissi, and Brahim Oujia, Questioning the structure of Sr+Arn clusters, Eur. Phys. J. D (2018) 72: 133.

18. Rafika Hamdi, Kawther Abdessalem, Riadh Dardouri, Attieh A Al-Ghamdi2, Brahim Oujia, and Florent Xavier Gadéa, Spectroscopic and electric dipole properties of Sr+Ar and SrAr systems including high excited states, J. Phys. B: At. Mol. Opt. Phys. 2018, 51(2), 025004.

19. Ben M'leh, C., Brandán, S.A., Issaoui, N., Roisnel, T., Marouani, H. Synthesis, molecular structure, vibrational and theoretical studies of a new non-centrosymmetric organic sulphate with promising NLO properties (2018) Journal of Molecular Structure, 1171, pp. 771-785.

20. Gatfaoui, S., Issaoui, N., Brandán, S.A., Roisnel, T., Marouani, H. Synthesis and characterization of p-xylylenediaminium bis(nitrate). Effects of the coordination modes of nitrate groups on their structural and vibrational properties (2018) Journal of Molecular Structure, 1151, pp. 152-168.

21. L. Mejrissi, H. Habli, B. Oujia, F. X. Gadéa, Charge transfer ionic character illustration for strontium hydride ion through a diabatic investigation. International Journal of Quantum Chemistry, 118, e25680 (2018).

22. S. Jellali, H. Habli, L. Mejrissi, R. Hamdi, B. Oujia, F. Xavier Gadéa. Spectroscopic and structural investigation for the ground and excited states of CaNa+ molecular ion. Journal of Quantitative Spectroscopy and Radiative Transfer, 209, 45-57 (2018).

23. Marwa Ben Manaa, Bruno Schmaltz, Nadia Bouaziz, Nicolas Berton, François Tran Van, Abdelmottaleb Ben Lamine, Adsorption isotherms of N3 dye on TiO2 mesoporous for dye sensitized solar cells: Their realization, their modeling and consequent interpretations using a statistical physics treatment, Journal of Alloys and Compounds 765 (2018) 385-395.

24. Lotfi Sellaoui, Felycia Edi Soetaredjo, Suryadi Ismadji, Adrián Bonilla-Petriciolet, Carolina Belver, Jorge Bedia, Abdelmottaleb Ben Lamine, Alessandro Erto, Insights on the statistical physics modeling of the adsorption of Cd2+ and Pb2+ ions on bentonite-chitosan composite in single and binary systems, Chemical Engineering Journal 354 (0018) 569-576.

25. Syahida Farhan Azha, Lotfi Sellaoui, Muhamad Sharafe Shamsudin, Suzylawati Ismail, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Alessandro Erto, Synthesis and characterization of a novel amphoteric adsorbent coating for anionic and cationic dyes adsorption: Experimental investigation and statistical physics modelling, Chemical Engineering Journal 351 (2018) 221-229.

26. Nadia Bouaziz, Marwa Ben Manaa, Abdelmottaleb Ben Lamine, Physicochemical and thermodynamic investigation of hydrogen absorption and desorption in LaNi3.8Al1.0Mn0.2 using the statistical physics modeling, results in physics 9 (2018) 1323-1334

27. Ismahene Ben Khemis, Nesrine Mechi, Abdelmottaleb Ben Lamine, Stereochemical study of mouse muscone receptor MOR215-1 and vibrational theory based on statistical physics formalism, Progress in Biophysics and Molecular Biology 136 (2018) 54-60.

28. Bouzid Mohamed, Zhu Qingyu, Geoff D. Moggridge, Ben Lamine Abdelmottaleb, New insight in adsorption of pyridine on the two modified adsorbents types MN200 and MN500 by means of grand canonical ensemble, Journal of Molecular Liquids 263 (2018) 413-421.

29. Lotfi Sellaoui, Didilia Ileana Mendoza-Castillob, Hilda Elizabeth Reynel-Ávilab, Adrián Bonilla-Petriciolet, Abdelmottaleb Ben Lamine, Alessandro Erto, A new statistical physics model for the ternary adsorption of Cu2+, Cd2+ and Zn2+ ions on bone char: Experimental investigation and simulations, Chemical Engineering Journal 343 (2018) 544-553.

30. Marwa Ben Manaa, Nadia Bouaziz, Bruno Schmaltz, François Tran Van, Abdelmottaleb Ben Lamine, Study of the effect of variation in temperature and pH on the adsorption process of natural gardenia yellow dye into TiO2 mesoporous for dye sensitized solar cells using the statistical physics formalism: Physicochemical and thermodynamic investigation, Microporous and Mesoporous Materials 270 (2018) 82-92.

31. Chaker Briki, Mohamed Bouzid, Mohamed Houcine Dhaou, Abdelmajid Jemni, Abdelmottaleb Ben Lamine, Experimental and theoretical study of hydrogen absorption by LaNi3.6Mn0.3Al0.4Co0.7 alloy using statistical physics modeling, International Journal of Hydrogen Energy 43 (2018) 9722–9732.

32. Lotfi Sellaoui, Felycia Edi Soetaredjo, Suryadi Ismadji, Yacine Benguerba, Guilherme L. Dotto, Adrián Bonilla-Petriciolet, Alírio E. Rodrigues, Abdelmottaleb Ben Lamine, Alessandro Erto, Equilibrium study of single and binary adsorption of lead and mercury on bentonite-alginate composite: Experiments and application of two theoretical approaches, Journal of Molecular Liquids 253 (2018) 160-168.

33. Nesrine Mechi , Ismahen Ben Khemis , Houcine Dhaou , Slim Zghal , Abdelmottaleb Ben Lamine, Structural characterization and hydrogen sorption properties of the Mg50Ni45Cr5 alloy, Chinese Journal of Physics 56 (2018) 449-467.

34. Nadia Bouaziz, Mohamed Bouzid, Abdelmottaleb Ben Lamine, Theoretical study of hydrogen absorption and desorption in Ti1-xZrxMn1.4 using statistical physics treatment: Microscopic investigation and thermodynamic potential interpretation, International Journal of Hydrogen Energy 43 (2018) 1615-1633.

35. Salah Knani, Nabil Mabrouk, Moncef Tounsi, Mohamed Ben Yahia, Statistical modeling of adsorption isotherm of potassium on aza[7] helicene-coated gold electrode attached to quartz crystal microbalance, Separation Science and Technology 54 (2018) 1-11.