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Dr. Simplice Koudjina
Dr. Simplice Koudjina
Assistant Professor in Computational Theoretical Chemistry for Nanotechnology Applications
在 unstim.bj 的电子邮件经过验证
标题
引用次数
引用次数
年份
Enhanced open-circuit voltage in polymer solar cells by dithieno [3, 2-b: 2′, 3′-d] pyrrole N-acylation
W Vanormelingen, J Kesters, P Verstappen, J Drijkoningen, J Kudrjasova, ...
Journal of Materials Chemistry A 2 (20), 7535-7545, 2014
392014
Fluorination as an effective tool to increase the open-circuit voltage and charge carrier mobility of organic solar cells based on poly (cyclopenta [2, 1-b: 3, 4-b …
P Verstappen, J Kesters, W Vanormelingen, GHL Heintges, ...
Journal of Materials Chemistry A 3 (6), 2960-2970, 2015
362015
Optoelectronic design and charge transport properties of Benzodifuran (BDF) isomers for organic electronic devices: DFT/TD-DFT insights
V Kumar, S Koudjina, P Verma, P Chetti
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 290, 122266, 2023
162023
Quantum mechanistic study of furan and 2-methylfuran hydrodeoxygenation on molybdenum and tungsten sulfide clusters
WG Kanhounnon, UA Kuevi, GA Kpotin, S Koudjina, AK Houngue, ...
Journal of Molecular Modeling 25, 1-11, 2019
122019
Impact of organic dye-photosensitizer on TiO2 nanocrystalline surface for high performance organic electronic devices: A computational insight
S Koudjina, V Kumar, GYS Atohoun, JD Gbenou, P Chetti
Journal of Photochemistry and Photobiology A: Chemistry 442, 114772, 2023
102023
DFT study of chemical reactivity of free radicals ABTS°+ and DPPH° by Myricetin, Quercetin and Kaempferol
MTAK Houngue, RC Doco, GA Kpotin, UA Kuevi, K Simplice, K Wilfried, ...
World Scientific News, 177-188, 2017
92017
Benzodithiophene (BDT) and benzodiselenophene (BDSe) isomers’ charge transport properties for organic optoelectronic devices
SKPC Vipin Kumar, Anuj Tripathi
Journal of Sulfur Chemistry 44 (1), 1-17, 2023
5*2023
Mechanistic enhanced cell voltage based on halides doped metal oxide fullerenes for use in Li-ion batteries: Insights from DFT intuition
N Kosar, S Koudjina, K Ayub, MA Gilani, M Imran, T Mahmood
Diamond and Related Materials 142, 110778, 2024
32024
Elimination of thiophenic compounds by cycloaddition with ethylene for an efficient purification of fuels: a DFT study
WG Kanhounnon, F Richard, GA Kpotin, S Koudjina, UA Kuevi, ...
Topics in Catalysis 64, 288-296, 2021
32021
Toward Bottom-up Optoelectronic Design of Increasing Fluorination Low Bandgap in PDTPQX-types Copolymers for Organic Photovoltaics Devices
S Koudjina, AS Thomas, R Sawadogo, NKN Guessan, WGKGA Kpotin, ...
International Journal of Computational and Theoretical Chemistry 9 (2), 32-42, 2021
32021
Quantum chemical hydrogenolysis strategy for elimination of heteroatoms in biomass homologous organic compounds based on oxolane and thiolane
S Koudjina, WG Kanhounnon, GA Kpotin, AS Thomas, R Sawadogo, ...
Journal of Molecular Graphics and Modelling 116, 108268, 2022
22022
Investigation of pyrrolidine hydrodenitrogenation modelling on theoretical catalysts sites under hydrogen pressure
S Koudjina, UA Kuevi, YGS Atohoun, GA Kpotin, A MT, K Houngue, ...
Journal of Computational Methods in Molecular Design 5 (3), 69-78, 2015
22015
Modeling of oxolane hydrodeoxygenation in the presence of tungsten disulfide
S Koudjina, YGS Atohoun, M Houngue, UA Kuevi, GA Kpotin, ...
Journal of Structural Chemistry 59, 290-296, 2018
12018
Comparative study of hydrogenolysis of a CX bond in three homologous heterocyclic compounds of chemical formula C5H10X with X= S, O and NH
YGS Atohoun, UA Kuevi, GA Kpotin, AK Houngue, S Koudjina, ...
Am. J. Sci. Ind. Res. 3 (6), 430-440, 2012
12012
Strategic Phytochemical Analysis of Hemostatic and Anti-inflammatory Bioactivities from the Hydroethanol extract of the trunk bark of Sclerocarya birrea (A. Rich) Hoscht
AP TCHOGOU, S Koudjina, S Chokki, AG Houngbeme, L Baba-moussa, ...
2024
Molecular engineering strategy and optoelectronic properties of diaminobenzene-thiazole π-conjugated small donor molecules for high-performance organic solar cells
R Sawadogo, S Koudjina, V Kumar, B Moussa, JM Sotiropoulos, ...
Computational and Theoretical Chemistry 1238, 114729, 2024
2024
Theoretical study of the catalytic hydrodeoxygenation of furan, methylfuran and benzofurane on MoS2
SLMB Wilfried G. Kanhounnon, Saber Gueddida, Simplice Koudjina, Frédéric ...
RSC Advances 31 (14), 22540-22547, 2024
2024
Adsorption Behavior of Copper and Paracetamol Residues in Removal Strategy from Hospital Wastewater on Beninese Kaolinite Surface
WKC François Zagabe Zabene, Simplice Koudjina, Alidor Mbaya Shikika ...
Journal of Materials Physics and Chemistry 12 (2), 22-30, 2024
2024
Biomass residues purification: elimination of oxygen from oxolane and its monomethylated derivatives through hydrodeoxygenation process
S Koudjina, N Kosar, GA Kpotin, AS Thomas, T Mahmood, GYS Atohoun
Physica Scripta 99 (4), 045402, 2024
2024
Phytochemical Analysis and Bioactivities Studies of Fresh Leaves and Flowers from C. roseus, L. multiflora and P. amarus, Beninese Medicinal Plants Used …
S Koudjina, AG Houngbeme, IDP Agbogba, GYS Atohoun, JD Gbenou
International Journal of Pharmacy and Chemistry 9 (5), 56-66, 2023
2023
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