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 | 78 | 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 | 65 | 2008 |
Some aspects of self-consistent propagator theories MD Prasad, S Pal, D Mukherjee Physical Review A 31 (3), 1287, 1985 | 63 | 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 | 58 | 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 | 45 | 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 | 34 | 1988 |
On certain correspondences among various coupled-cluster theories for closed-shell systems S Pal, MD Prasad, D Mukherjee Pramana 18, 261-270, 1982 | 30 | 1982 |
Time‐dependent coupled cluster approach to multimode vibronic dynamics GS Latha, MD Prasad The Journal of chemical physics 105 (8), 2972-2977, 1996 | 29 | 1996 |
Effective harmonic osciollator description of anharmonic molecular vibrations TK Roy, MD Prasad Journal of chemical sciences 121, 805, 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 |
Vibrational multi-reference coupled cluster theory in bosonic representation S Banik, S Pal, MD Prasad The Journal of Chemical Physics 137 (11), 2012 | 25 | 2012 |
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 | 24 | 2009 |
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 | 23 | 2009 |
Finite temperatire vibronic spectra of harmonic surfaces : A time-dependent coupled cluster approach CS Reddy, MD Prasad molecular Physics 113 (19-20), 3023-3030, 2015 | 18 | 2015 |
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 | 18 | 2010 |
The time-dependent coupled cluster approach to molecular photodissociation dynamics GM Sastry, MD Prasad Chemical physics letters 228 (1-3), 213-218, 1994 | 17 | 1994 |
Calculation of vibrational spectra by the coupled cluster method - Applications to H2S MD Prasad NISCAIR-CSIR, India, 2000 | 16 | 2000 |
Development of a new variational approach for thermal density matrices TK Roy, MD Prasad The Journal of chemical physics 134 (21), 2011 | 13 | 2011 |
On the calculation of expectation values and transition matrix elements by coupled cluster method MD Prasad Theoretica chimica acta 88, 383-388, 1994 | 13 | 1994 |