Use of a size-consistent energy functional in many electron theory for closed shells S Pal, M Durga Prasad, D Mukherjee Theoretica chimica acta 62, 523-536, 1983 | 79 | 1983 |
Calculation of vibrational energy of molecule using coupled cluster linear response theory in bosonic representation: Convergence studies S Banik, S Pal, MD Prasad The Journal of chemical physics 129 (13), 2008 | 70 | 2008 |
Some aspects of self-consistent propagator theories MD Prasad, S Pal, D Mukherjee Physical Review A 31 (3), 1287, 1985 | 66 | 1985 |
Coupled cluster description of anharmonic molecular vibrations. Application to O3 and SO2 V Nagalakshmi, V Lakshminarayana, G Sumithra, MD Prasad Chemical physics letters 217 (3), 279-282, 1994 | 59 | 1994 |
Molecular applications of open-shell coupled cluster theory for energy difference calculations: ionization and auger spectra of F2 D Sinha, SK Mukhopadhay, MD Prasad, D Mukherjee Chemical physics letters 125 (3), 213-217, 1986 | 46 | 1986 |
Development of a size-consistent energy functional for open shell states S Pal, M Durga Prasad, D Mukherjee Theoretica chimica acta 66, 311-332, 1984 | 39 | 1984 |
Time‐dependent coupled cluster method: A new approach to the calculation of molecular absorption spectra MD Prasad The Journal of chemical physics 88 (11), 7005-7010, 1988 | 37 | 1988 |
Facet-engineered surfaces of two-dimensional layered BiOI and Au–BiOI substrates for tuning the surface-enhanced Raman scattering and visible light photodetector response MD Prasad, MG Krishna, SK Batabyal ACS Applied Nano Materials 2 (6), 3906-3915, 2019 | 35 | 2019 |
Hydrochemical assessment of groundwater in alluvial aquifer region, Jalandhar District, Punjab, India R Dhakate, GR VV S Environmental Earth Sciences 73, 8145-8153, 2015 | 32 | 2015 |
Time‐dependent coupled cluster approach to multimode vibronic dynamics GS Latha, MD Prasad The Journal of chemical physics 105 (8), 2972-2977, 1996 | 32 | 1996 |
On certain correspondences among various coupled-cluster theories for closed-shell systems S Pal, MD Prasad, D Mukherjee Pramana 18, 261-270, 1982 | 32 | 1982 |
Vibrational multi-reference coupled cluster theory in bosonic representation S Banik, S Pal, MD Prasad The Journal of Chemical Physics 137 (11), 2012 | 27 | 2012 |
Effective harmonic oscillator description of anharmonic molecular vibrations TK Roy, Prasad, M. Durga Journal of chemical sciences 121, 805, 2009 | 27 | 2009 |
On some strategies to design new high energy density molecules T Mondal, B Saritha, S Ghanta, TK Roy, S Mahapatra, MD Prasad Journal of Molecular Structure: THEOCHEM 897 (1-3), 42-47, 2009 | 26 | 2009 |
Self-consistent-field dynamics of a model non-adiabatic system MD Prasad Chemical physics letters 194 (1-2), 27-31, 1992 | 26 | 1992 |
Single and twinned plates of 2D layered BiI 3 for use as nanoscale pressure sensors MD Prasad, LDV Sangani, SK Batabyal, MG Krishna CrystEngComm 20 (33), 4857-4866, 2018 | 24 | 2018 |
A thermal self-consistent field theory for the calculation of molecular vibrational partition functions TK Roy, MD Prasad The Journal of chemical physics 131 (11), 2009 | 24 | 2009 |
Calculation of dipole transition matrix elements and expectation values by vibrational coupled cluster method S Banik, S Pal, MD Prasad Journal of Chemical Theory and Computation 6 (10), 3198-3204, 2010 | 20 | 2010 |
One-dimensional SbSI crystals from Sb, S, and I mixtures in ethylene glycol for solar energy harvesting AK Pathak, MD Prasad, SK Batabyal Applied Physics A 125 (3), 213, 2019 | 19 | 2019 |
Finite temperature vibronic spectra of harmonic surfaces : A time-dependent coupled cluster approach C Sridhar Reddy, MD Prasad Molecular Physics 113, 3023, 2015 | 19 | 2015 |