Chemical reactivity theory: a density functional view PK Chattaraj CRC press, 2009 | 484 | 2009 |
Molecular tailoring approach for geometry optimization of large molecules: Energy evaluation and parallelization strategies V Ganesh, RK Dongare, P Balanarayan, SR Gadre The Journal of chemical physics 125 (10), 2006 | 290 | 2006 |
Topography of molecular scalar fields. I. Algorithm and Poincaré–Hopf relation P Balanarayan, SR Gadre The Journal of chemical physics 119 (10), 5037-5043, 2003 | 125 | 2003 |
Signatures of molecular recognition from the topography of electrostatic potential DK Roy, P Balanarayan, SR Gadre Journal of Chemical Sciences 121, 815-821, 2009 | 39 | 2009 |
An appraisal of Poincaré–Hopf relation and application to topography of molecular electrostatic potentials D Roy, P Balanarayan, SR Gadre The Journal of chemical physics 129 (17), 2008 | 39 | 2008 |
Electrostatic potential topography for exploring electronic reorganizations in 1, 3 dipolar cycloadditions P Balanarayan, R Kavathekar, SR Gadre The Journal of Physical Chemistry A 111 (14), 2733-2738, 2007 | 36 | 2007 |
Why are carborane acids so acidic? An electrostatic interpretation of Brĝnsted acid strengths P Balanarayan, SR Gadre Inorganic chemistry 44 (26), 9613-9615, 2005 | 25 | 2005 |
Strong chemical bond of stable He in strong linearly polarized laser fields P Balanarayan, N Moiseyev Physical Review A—Atomic, Molecular, and Optical Physics 85 (3), 032516, 2012 | 21 | 2012 |
PAREMD: A parallel program for the evaluation of momentum space properties of atoms and molecules DR Meena, SR Gadre, P Balanarayan Computer physics communications 224, 299-310, 2018 | 20 | 2018 |
Atoms-in-molecules in momentum space: a Hirshfeld partitioning of electron momentum densities P Balanarayan, SR Gadre The Journal of chemical physics 124 (20), 2006 | 20 | 2006 |
Ab-initio complex molecular potential energy surfaces by the back-rotation transformation method P Balanarayan, Y Sajeev, N Moiseyev Chemical Physics Letters 524, 84-89, 2012 | 15 | 2012 |
Can ring strain be realized in momentum space? P Balanarayan, SR Gadre Journal of the American Chemical Society 128 (33), 10702-10706, 2006 | 15 | 2006 |
Electrophilic additions to a 2-methylenebicyclo [2.1. 1] hexane system: Probing π-face selectivity for electrostatic and orbital effects G Mehta, SR Singh, P Balanarayan, SR Gadre Organic Letters 4 (14), 2297-2300, 2002 | 12 | 2002 |
A computational investigation of the solvent-dependent enantioselective intramolecular Morita–Baylis–Hillman reaction of enones NK Singh, B Satpathi, P Balanarayan, SSV Ramasastry Organic & Biomolecular Chemistry 15 (48), 10212-10220, 2017 | 10 | 2017 |
Linear Stark effect for a sulfur atom in strong high-frequency laser fields P Balanarayan, N Moiseyev Phys. Rev. Lett 110, 253001, 2013 | 8 | 2013 |
A balancing act of two electrons on a symmetric double-well barrier in a high frequency oscillating field P Raj, B Pananghat Physical Chemistry Chemical Physics 21 (6), 3184-3194, 2019 | 7 | 2019 |
Hovering states of ammonia in a high-intensity, high-frequency oscillating field: trapped into planarity by laser-induced hybridization N Kumar, P Raj, P Balanarayan The Journal of Physical Chemistry Letters 10 (21), 6813-6819, 2019 | 6 | 2019 |
Chemistry in high-frequency strong laser fields: The story of HeS molecule P Balanarayan, N Moiseyev Molecular Physics 111 (12-13), 1814-1822, 2013 | 6 | 2013 |
Sulfur-mediated chalcogen versus hydrogen bonds in proteins: a see-saw effect in the conformational space VA Adhav, SS Shelke, P Balanarayan, K Saikrishnan QRB discovery 4, e5, 2023 | 3 | 2023 |
Quantum Dynamics with Explicitly Time-Dependent Hamiltonians in Multiple Time Scales: A New Algorithm for (t, t′) and (t, t′, t″) Methods in Laser–Matter … P Raj, A Gugalia, P Balanarayan Journal of Chemical Theory and Computation 16 (1), 35-50, 2019 | 2 | 2019 |