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P. Tarakeshwar
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Molecular clusters of π-systems: theoretical studies of structures, spectra, and origin of interaction energies
KS Kim, P Tarakeshwar, JY Lee
Chemical reviews 100 (11), 4145-4186, 2000
11272000
Understanding of assembly phenomena by aromatic− aromatic interactions: benzene dimer and the substituted systems
EC Lee, D Kim, P Jurecka, P Tarakeshwar, P Hobza, KS Kim
The Journal of Physical Chemistry A 111 (18), 3446-3457, 2007
6662007
Structures, energies, vibrational spectra, and electronic properties of water monomer to decamer
HM Lee, SB Suh, JY Lee, P Tarakeshwar, KS Kim
The Journal of Chemical Physics 112 (22), 9759-9772, 2000
3342000
Geometrical and electronic structures of gold, silver, and gold− silver binary clusters: Origins of ductility of gold and gold− silver alloy formation
HM Lee, M Ge, BR Sahu, P Tarakeshwar, KS Kim
The Journal of Physical Chemistry B 107 (37), 9994-10005, 2003
3242003
Theoretical investigations of anion− π interactions: the role of anions and the nature of π systems
D Kim, P Tarakeshwar, KS Kim
The Journal of Physical Chemistry A 108 (7), 1250-1258, 2004
2952004
Cation− π interactions: a theoretical investigation of the interaction of metallic and organic cations with alkenes, arenes, and heteroarenes
D Kim, S Hu, P Tarakeshwar, KS Kim, JM Lisy
The Journal of Physical Chemistry A 107 (8), 1228-1238, 2003
2572003
Olefinic vs aromatic π− h interaction: a theoretical investigation of the nature of interaction of first-row hydrides with ethene and benzene
P Tarakeshwar, HS Choi, KS Kim
Journal of the American Chemical Society 123 (14), 3323-3331, 2001
2202001
Substituent effects on the edge-to-face aromatic interactions
EC Lee, BH Hong, JY Lee, JC Kim, D Kim, Y Kim, P Tarakeshwar, KS Kim
Journal of the American Chemical Society 127 (12), 4530-4537, 2005
2182005
Insights into the Structures, Energetics, and Vibrations of Monovalent Cation−(Water)1-6 Clusters
HM Lee, P Tarakeshwar, J Park, MR Kołaski, YJ Yoon, HB Yi, WY Kim, ...
The Journal of Physical Chemistry A 108 (15), 2949-2958, 2004
1832004
A theoretical investigation of the nature of the π-H interaction in ethene– benzene– and benzene–
P Tarakeshwar, HS Choi, SJ Lee, JY Lee, KS Kim, TK Ha, JH Jang, ...
The Journal of chemical physics 111 (13), 5838-5850, 1999
1531999
A nickel phosphine complex as a fast and efficient hydrogen production catalyst
L Gan, TL Groy, P Tarakeshwar, SKS Mazinani, J Shearer, V Mujica, ...
Journal of the American Chemical Society 137 (3), 1109-1115, 2015
1392015
Assembling Phenomena of Calix [4] hydroquinone Nanotube Bundles by One-Dimensional Short Hydrogen Bonding and Displaced π− π Stacking
KS Kim, SB Suh, JC Kim, BH Hong, EC Lee, S Yun, P Tarakeshwar, ...
Journal of the American Chemical Society 124 (47), 14268-14279, 2002
1222002
Characterization of weak NH− π intermolecular interactions of ammonia with various substituted π-systems
S Vaupel, B Brutschy, P Tarakeshwar, KS Kim
Journal of the American Chemical Society 128 (16), 5416-5426, 2006
1172006
Cation− π− Anion Interaction: A Theoretical Investigation of the Role of Induction Energies
D Kim, EC Lee, KS Kim, P Tarakeshwar
The Journal of Physical Chemistry A 111 (32), 7980-7986, 2007
1142007
Role of Lewis Acid(AlCl3)−Aromatic Ring Interactions in Friedel−Craft's Reaction:  An ab Initio Study
P Tarakeshwar, JY Lee, KS Kim
The Journal of Physical Chemistry A 102 (13), 2253-2255, 1998
1141998
Fluorobenzene⋯water and difluorobenzene⋯water systems: An ab initio investigation
P Tarakeshwar, KS Kim, B Brutschy
The Journal of chemical physics 110 (17), 8501-8512, 1999
1081999
Origin of the magic numbers of water clusters with an excess electron
HM Lee, SB Suh, P Tarakeshwar, KS Kim
The Journal of chemical physics 122 (4), 044309, 2005
1052005
Simple and accurate correlation of experimental redox potentials and DFT-calculated HOMO/LUMO energies of polycyclic aromatic hydrocarbons
DD Méndez-Hernández, P Tarakeshwar, D Gust, TA Moore, AL Moore, ...
Journal of molecular modeling 19 (7), 2845-2848, 2013
1002013
Surface-enhanced Raman scattering on semiconducting oxide nanoparticles: oxide nature, size, solvent, and pH effects
P Tarakeshwar, D Finkelstein-Shapiro, SJ Hurst, T Rajh, V Mujica
The Journal of Physical Chemistry C 115 (18), 8994-9004, 2011
862011
Benzene-hydrogen halide interactions: Theoretical studies of binding energies, vibrational frequencies, and equilibrium structures
P Tarakeshwar, SJ Lee, JY Lee, KS Kim
The Journal of chemical physics 108 (17), 7217-7223, 1998
831998
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Articles 1–20