Follow
SenthilKumar K
SenthilKumar K
Verified email at buc.edu.in
Title
Cited by
Cited by
Year
Charge transport properties in discotic liquid crystals: a quantum-chemical insight into structure− property relationships
V Lemaur, DA da Silva Filho, V Coropceanu, M Lehmann, Y Geerts, ...
Journal of the American Chemical Society 126 (10), 3271-3279, 2004
5692004
Charge transport in columnar stacked triphenylenes: Effects of conformational fluctuations on charge transfer integrals and site energies
K Senthilkumar, FC Grozema, FM Bickelhaupt, LDA Siebbeles
The Journal of chemical physics 119 (18), 9809-9817, 2003
4562003
Absolute rates of hole transfer in DNA
K Senthilkumar, FC Grozema, CF Guerra, FM Bickelhaupt, FD Lewis, ...
Journal of the American Chemical Society 127 (42), 14894-14903, 2005
3862005
Mapping the sites for selective oxidation of guanines in DNA
K Senthilkumar, FC Grozema, CF Guerra, FM Bickelhaupt, LDA Siebbeles
Journal of the American Chemical Society 125 (45), 13658-13659, 2003
1152003
N-heterocycles as corrosion inhibitors for mild steel in acid medium
J Saranya, M Sowmiya, P Sounthari, K Parameswari, S Chitra, ...
Journal of Molecular Liquids 216, 42-52, 2016
1132016
Charge Transport in Self-Organized π-Stacks of p-Phenylene Vinylene Oligomers
P Prins, K Senthilkumar, FC Grozema, P Jonkheijm, APHJ Schenning, ...
The Journal of Physical Chemistry B 109 (39), 18267-18274, 2005
992005
Calculation of ionization potential and chemical hardness: a comparative study of different methods
R Shankar, K Senthilkumar, P Kolandaivel
International Journal of Quantum Chemistry 109 (4), 764-771, 2009
662009
Graphene Quantum Dot Solid Sheets: Strong blue-light-emitting & photocurrent-producing band-gap-opened nanostructures
G Bharathi, D Nataraj, S Premkumar, M Sowmiya, K Senthilkumar, ...
Scientific reports 7 (1), 10850, 2017
652017
Copper (I) hydrazone complexes: Synthesis, structure, DNA binding, radical scavenging and computational studies
P Krishnamoorthy, P Sathyadevi, K Senthilkumar, PT Muthiah, R Ramesh, ...
Inorganic Chemistry Communications 14 (9), 1318-1322, 2011
632011
Analysis of polarization in QM/MM modelling of biologically relevant hydrogen bonds
K Senthilkumar, JI Mujika, KE Ranaghan, FR Manby, AJ Mulholland, ...
Journal of the Royal Society Interface 5 (suppl_3), 207-216, 2008
612008
Quantum chemical studies on tautomerism of barbituric acid in gas phase and in solution
K Senthilkumar, P Kolandaivel
Journal of computer-aided molecular design 16, 263-272, 2002
522002
Optical Absorption and Emission Properties of Fluoranthene, Benzo[k]fluoranthene, and Their Derivatives. A DFT Study
G Saranya, P Kolandaivel, K Senthilkumar
The Journal of Physical Chemistry A 115 (51), 14647-14656, 2011
502011
Ultrasonic, DFT and FT-IR studies on hydrogen bonding interactions in aqueous solutions of diethylene glycol
MS Raman, M Kesavan, K Senthilkumar, V Ponnuswamy
Journal of Molecular Liquids 202, 115-124, 2015
422015
Ab initio and DFT studies on structure and stability of aliphatic aldoxime molecules
P Kolandaivel, K Senthilkumar
Journal of Molecular Structure: THEOCHEM 535 (1-3), 61-70, 2001
412001
Structural and spectral properties of 4-bromo-1-naphthyl chalcones: a quantum chemical study
R Nithya, N Santhanamoorthi, P Kolandaivel, K Senthilkumar
The Journal of Physical Chemistry A 115 (24), 6594-6602, 2011
392011
Effect of structural fluctuations on charge carrier mobility in thiophene, thiazole and thiazolothiazole based oligomers
K Navamani, G Saranya, P Kolandaivel, K Senthilkumar
Physical Chemistry Chemical Physics 15 (41), 17947-17961, 2013
372013
Theoretical studies on the quinoidal thiophene based dyes for dye sensitized solar cell and NLO applications
R Nithya, K Senthilkumar
Physical Chemistry Chemical Physics 16 (39), 21496-21505, 2014
352014
Interactions of anticancer drugs with usual and mismatch base pairs—Density functional theory studies
P Deepa, P Kolandaivel, K Senthilkumar
Biophysical chemistry 136 (1), 50-58, 2008
352008
Theoretical and experimental evaluation of a new organic proton transfer crystal aminoguanidinium p-nitrobenzoate monohydrate for optical limiting applications
T Shanmugavadivu, K Senthilkumar, M Dhandapani, P Muthuraja, ...
Journal of Physics and Chemistry of Solids 111, 82-94, 2017
342017
Copper Ion Mediated Selective Cleavage of C–S Bond in Ferrocenylthiosemicarbazone Forming Mixed Geometrical [(PPh3) Cu (μ-S) 2Cu (PPh3) 2] Having Cu2S2 Core: Toward a New …
R Prabhakaran, P Kalaivani, SV Renukadevi, R Huang, K Senthilkumar, ...
Inorganic Chemistry 51 (6), 3525-3532, 2012
342012
The system can't perform the operation now. Try again later.
Articles 1–20