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Malloum, Alhadji, Fifen, Jean Jules, Conradie, Jeanet (2019) Exploration of the potential energy surface of the ethanol hexamer. The Journal of Chemical Physics, 150 (12). 124308pp. doi:10.1063/1.5085843

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Reference TypeJournal (article/letter/editorial)
TitleExploration of the potential energy surface of the ethanol hexamer
JournalThe Journal of Chemical Physics
AuthorsMalloum, AlhadjiAuthor
Fifen, Jean JulesAuthor
Conradie, JeanetAuthor
Year2019 (March 28)Volume150
Issue12
PublisherAIP Publishing
DOIdoi:10.1063/1.5085843Search in ResearchGate
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Mindat Ref. ID2403075Long-form Identifiermindat:1:5:2403075:5
GUID0
Full ReferenceMalloum, Alhadji, Fifen, Jean Jules, Conradie, Jeanet (2019) Exploration of the potential energy surface of the ethanol hexamer. The Journal of Chemical Physics, 150 (12). 124308pp. doi:10.1063/1.5085843
Plain TextMalloum, Alhadji, Fifen, Jean Jules, Conradie, Jeanet (2019) Exploration of the potential energy surface of the ethanol hexamer. The Journal of Chemical Physics, 150 (12). 124308pp. doi:10.1063/1.5085843
In(2019, March) The Journal of Chemical Physics Vol. 150 (12) AIP Publishing

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Malloum, Alhadji, Fifen, Jean Jules, Conradie, Jeanet (2018) Structures and spectroscopy of the ammonia eicosamer, (NH3)n=20. The Journal of Chemical Physics, 149 (2). 24304pp. doi:10.1063/1.5031790
Malloum, Alhadji, Fifen, Jean Jules, Conradie, Jeanet (2018) Structures and infrared spectroscopy of large sized protonated ammonia clusters. The Journal of Chemical Physics, 149 (24). 244301pp. doi:10.1063/1.5053172
Malloum, Alhadji, Fifen, Jean Jules, Conradie, Jeanet (2018) Solvation energies of the proton in methanol revisited and temperature effects. Physical Chemistry Chemical Physics, 20 (46). 29184-29206 doi:10.1039/c8cp05823g
Malloum, Alhadji, Fifen, Jean Jules, Dhaouadi, Zoubeida, Nana Engo, Serge Guy, Conradie, Jeanet (2019) Structures, relative stability and binding energies of neutral water clusters, (H2O)2–30. New Journal of Chemistry, 43. 13020-13037 doi:10.1039/c9nj01659g
Boukar, Ousman, Fifen, Jean Jules, Malloum, Alhadji, Dhaouadi, Zoubeida, Ghalila, Hassen, Conradie, Jeanet (2019) Structures of solvated ferrous ion clusters in ammonia and spin-crossover at various temperatures. New Journal of Chemistry, 43. 9902-9915 doi:10.1039/c9nj02462j
Da-yang, Tabouli Eric, Fifen, Jean Jules, Malloum, Alhadji, Lahmar, Souad, Nsangou, Mama, Conradie, Jeanet (2020) Structures of the solvated copper(ii) ion in ammonia at various temperatures. New Journal of Chemistry, 44. 3637-3653 doi:10.1039/c9nj05169d
Maya, Josué, Malloum, Alhadji, Fifen, Jean Jules, Dhaouadi, Zoubeida, Fouda, Henri Paul Ekobena, Conradie, Jeanet (2024) Quantum cluster equilibrium theory applied to liquid ammonia. Journal of Computational Chemistry, 45 (15) 1279-1288 doi:10.1002/jcc.27327
Malloum, Alhadji, Fifen, Jean J., Conradie, Jeanet (2020) Large‐Sized Ammonia Clusters and Solvation Energies of the Proton in Ammonia. Journal of Computational Chemistry, 41 (1). 21-30 doi:10.1002/jcc.26071
Da-yang, Tabouli Eric, Fifen, Jean Jules, Conradie, Jeanet (2025) Exploration of the potential energy surfaces of the Cu2+(MeOH)n=9,10 clusters: Solvent phase vs gas phase. Chemical Physics, 590. doi:10.1016/j.chemphys.2024.112536
Malloum, Alhadji, Fifen, Jean Jules, Dhaouadi, Zoubeida, Engo, Serge Guy Nana, Jaidane, Nejm-Eddine (2017) Solvation energies of the proton in ammonia explicitly versus temperature. The Journal of Chemical Physics, 146 (13). 134308pp. doi:10.1063/1.4979568
Malloum, Alhadji, Conradie, Jeanet (2023) DFT benchmarking for adsorption energy in wastewater treatment. Molecular Physics, 121 (23) doi:10.1080/00268976.2023.2241919
 
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