Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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11 |
Material Type: Artigo
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In silico design of a new Zn–triazole based metal–organic framework for CO2 and H2O adsorptionDahmani, R. ; Grubišić, S. ; Djordjević, I. ; Ben Yaghlane, S. ; Boughdiri, S. ; Chambaud, G. ; Hochlaf, M.The Journal of chemical physics, 2021-01, Vol.154 (2), p.024303-024303 [Periódico revisado por pares]Melville: American Institute of PhysicsTexto completo disponível |
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12 |
Material Type: Artigo
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Explicitly correlated potential energy surface of the CH3Cl–He van der Waals complex and applicationsBen Krid, A. ; Ajili, Y. ; Ben Abdallah, D. ; Dhib, M. ; Aroui, H. ; Hochlaf, M.The Journal of chemical physics, 2021-03, Vol.154 (9), p.094304-094304 [Periódico revisado por pares]Melville: American Institute of PhysicsTexto completo disponível |
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13 |
Material Type: Artigo
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Identification of a Grotthuss proton hopping mechanism at protonated polyhedral oligomeric silsesquioxane (POSS) – water interfaceMaiyelvaganan, K.R. ; Kamalakannan, S. ; Shanmugan, S. ; Prakash, M. ; Coudert, F.-X. ; Hochlaf, M.Journal of colloid and interface science, 2022-01, Vol.605, p.701-709 [Periódico revisado por pares]Elsevier IncTexto completo disponível |
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14 |
Material Type: Artigo
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Generation of full dimensional potential energy surfaces for atmospherically important charge transfer tetratomic complexes: the case of the OMgOO+ radical cationYazidi, O ; Hochlaf, MPhysical chemistry chemical physics : PCCP, 2013-07, Vol.15 (25), p.10158-10166 [Periódico revisado por pares]England: Royal Society of ChemistryTexto completo disponível |
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15 |
Material Type: Artigo
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Characterization and photochemistry of XCO2 (X = F, NH2, CH3) radicalsKechoindi, S. ; Ben Yaghlane, S. ; Terzi, N. ; Palaudoux, J. ; Hochlaf, M.The European physical journal. ST, Special topics, 2023-09, Vol.232 (12), p.1905-1916 [Periódico revisado por pares]Berlin/Heidelberg: Springer Berlin HeidelbergTexto completo disponível |
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16 |
Material Type: Artigo
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Theoretical treatment of IO-X (X = N 2 , CO, CO 2 , H 2 O) complexesMarzouk, S ; Ajili, Y ; Ben El Hadj Rhouma, M ; Ben Said, R ; Hochlaf, MPhysical chemistry chemical physics : PCCP, 2022-03, Vol.24 (12), p.7203-7213 [Periódico revisado por pares]England: Royal Society of ChemistryTexto completo disponível |
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17 |
Material Type: Artigo
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Collision excitation of nitrous acid (HONO) by helium: isomerization effectAbdallah, D Ben ; Mogren, M Mogren Al ; Harbi, S Dhaif Allah Al ; Salhi, M S Al ; Hochlaf, MMonthly notices of the Royal Astronomical Society, 2023-05, Vol.521 (3), p.4162-4172 [Periódico revisado por pares]Oxford University PressTexto completo disponível |
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18 |
Material Type: Artigo
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Carbazole derivatives containing chalcone analogues targeting topoisomerase II inhibition: First principles characterization and QSAR modellingGhamri, M. ; Harkati, D. ; Belaidi, S. ; Boudergua, S. ; Said, R. Ben ; Linguerri, R. ; Chambaud, G. ; Hochlaf, M.Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2020-12, Vol.242, p.118724, Article 118724 [Periódico revisado por pares]England: Elsevier B.VTexto completo disponível |
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19 |
Material Type: Artigo
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Collisional (de-)excitation of protonated cyanoacetylene (HC3NH+) by helium at low and moderate temperaturesAl Mogren, M Mogren ; Ben Abdallah, D ; Al Harbi, S Dhaif Allah ; Al Salhi, M S ; Hochlaf, MMonthly notices of the Royal Astronomical Society, 2021-05, Vol.503 (2), p.2902-2912 [Periódico revisado por pares]Oxford University PressTexto completo disponível |
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20 |
Material Type: Artigo
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Spin-Orbit Effects in the Spectroscopy of the X 2 Π and a 4 Σ - Electronic States of Carbon Iodide, CIKhiri, D ; Hochlaf, M ; Maroulis, G ; Chambaud, GThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2018-03, Vol.122 (9), p.2353-2360 [Periódico revisado por pares]United StatesTexto completo disponível |