Senthilkumar L
Senthilkumar L
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Adsorption behaviour of reduced graphene oxide towards cationic and anionic dyes: Co-action of electrostatic and π – π interactions
RTRK Cherukutty Ramakrishnan Minitha, Murugan Lalitha, Yekkoni Lakshmanan ...
Materials Chemistry and Physics, 2017
Calcium Decorated and Doped Phosphorene for Gas Adsorption
M lalitha, Y Natara, S Lakshmipathi
Applied Surface Science 377, 311-323, 2016
Interaction studies of cysteine with Li+, Na+, K+, Be2+, Mg2+, and Ca2+ metal cation complexes
R Shankar, P Kolandaivel, L Senthilkumar
Journal of Physical Organic Chemistry 24 (7), 553-567, 2011
Hydrogen bonding in substituted formic acid dimers
L Senthilkumar, TK Ghanty, SK Ghosh, P Kolandaivel
The Journal of Physical Chemistry A 110 (46), 12623-12628, 2006
Electron density and energy decomposition analysis in hydrogen-bonded complexes of azabenzenes with water, acetamide, and thioacetamide
L Senthilkumar, TK Ghanty, SK Ghosh
The Journal of Physical Chemistry A 109 (33), 7575-7582, 2005
Multi walled Carbon Nanotube Oxygen Sensor: Enhanced Oxygen Sensitivity at Room Temperature and Mechanism of Sensing
R Vel, L Murugan, RJ Kullan, S Lakshmipathi, RKR Thangavelu
ACS Applied Materials & Interfaces, 2015
Theoretical studies on hydrogen bonding in caffeine–theophylline complexes
M Karthika, L Senthilkumar, R Kanakaraju
computational and theoretical chemistry 979, 54-63, 2012
Hydrogen-bonded complexes of serotonin with methanol and ethanol: a DFT study
AM Priya, L Senthilkumar, P Kolandaivel
Structural Chemistry 25 (1), 139-157, 2014
Coordination and binding properties of zwitterionic glutathione with transition metal cations
R Shankar, P Kolandaivel, L Senthil Kumar
Inorganica Chimca acta 387, 125-136, 2012
Influence of In-plane Stone-Thrower-Wales Defects and Edge Functionalisation on the Adsorption of CO2 and H2O on Graphene
L Murugan, S Lakshmipathi, SK Bhatia
RSC Advances 4, 39576-39587, 2014
Degradation of methyl salicylate through Cl initiated atmospheric oxidation - A theoretical study
MP Angappan, S Lakshmipathi
RSC Advances 4, 23464, 2014
Interface energetics of [Emim]+[X]− and [Bmim]+[X]− (X = BF4, Cl, PF6, TfO, Tf2N) based ionic liquids on graphene, defective graphene, and graphyne surfaces
L Murugan, L Senthilkumar
Journal of Molecular Liquids, 2017
DFT Study on X−.(H2O) n=1-10 (X=OH, NO2, NO3, CO3) Anionic Water Cluster
M Lalitha, L Senthilkumar
Journal of Molecular Graphics and Modelling 54, 148-163, 2014
Study of effective hardness and condensed Fukui functions using AIM, ab initio, and DFT methods
L Senthilkumar, P Kolandaivel*
Molecular Physics 103 (4), 547-556, 2005
Improved lithium adsorption in boron- and nitrogen substituted graphene derivatives
M Lalitha, SS Mahadevan, S Lakshmipathi
Journal of Material Science, 2016
Influence of metal ions (Zn2+, Cu2+, Ca2+, Mg2+ and Na+) on the water coordinated neutral and zwitterionic L-Histidine dimer
P Umadevi, L Senthilkumar
RSC Advances 4, 49040-49052, 2014
Defect-Mediated Reduction in Barrier for Helium Tunneling through Functionalized Graphene Nanopores
L Murugan, L Senthilkumar, SK Bhatia
The Journal of Physical Chemistry C 119 (36), 20940, 2015
Theoretical investigations on the hydrogen bonding of nitrile isomers with H2O, HF, NH3 and H2S
V Umadevi, L Senthilkumar, P Kolandaivel
Molecular Simulation 39 (11), 908-921, 2013
H, OH and COOH functionalized magnesium phthalocyanine as a catalyst for oxygen reduction reaction (ORR) – A DFT study
T Thangaraj, A Agnes Lincy, A Basheer, S Ramesh, L Senthilkumar
International Journal of Hydrogen Energy 45 (15), 8540-8548, 2020
Hydrogen-bond interactions in hydrated 6-selenoguanine tautomers: a theoretical study
M Karthika, L Senthilkumar, R Kanakaraju
Structural Chemistry 25 (1), 197-213, 2014
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