Orthonormality-constrained orbital optimisations in MC-SCF theory

Debashis Mukherjee
Proceedings of the Indian Academy of Sciences - Section A, Chemical Sciences 87 ( 1) 37 -43

1978
Use of cluster expansion techniques in quantum chemistry. A linear response model for calculating energy differences

Somnath Ghosh , Debashis Mukherjee
Proceedings of the Indian Academy of Sciences - Chemical Sciences 93 ( 6) 947 -963

1
1984
Ab initio determination of the lifetime of the 62P3/2 state for 207Pb+ by relativistic many-body theory

Rajat K Chaudhuri , Sonjoy Majumder , B P Das , Debashis Mukherjee
Journal of Physics B 37 ( 17) 3409 -3418

35
2004
CHEMICAL REACTION VOLUME FOR DIATOMIC DISSOCIATION PROCESS

A Guha , Debashis Mukherjee
Indian journal of chemistry. Sect. A: Inorganic, physical, theoretical & analytical 36 ( 2) 133 -136

1997
Stochastically averaged subdynamics of two-level systems (TLS) coupled to a colored noise: a nonperturbative time-ordered cluster cumulant method

Rathindranath Ghosh , Sheikh Hannan Mandal , Debashis Mukherjee
Journal of the Indian Chemical Society 80 ( 5) 411 -417

2003
Role of mathematics in chemistry

Debashis Mukherjee
Current Science 88 ( 3) 371 -373

2005
Core polarization in coupled-cluster theory induced by a parity and time-reversal violating interaction

K V P Latha , Rajat K Chaudhuri , B P Das , Debashis Mukherjee
Journal of Physics B 41 ( 3) 035005

4
2008
Effective π -electron Hamiltonian for small-radius nanotubes: Interpretation of curvature-induced conductivity

Péter Szakács , Péter R Surján , Debashis Mukherjee , Sanghamitra Das
Physical Review B 77 ( 19) 193407

4
2008
Consistent propagator theory based on the extended coupled-cluster parametrization of the ground state

Barnali Datta , Debasis Mukhopadhyay , Debashis Mukherjee
Physical Review A 47 ( 5) 3632 -3648

17
1993
The construction of a size-extensive intermediate Hamiltonian in a coupled-cluster framework

Debasis Mukhopadhyay , Barnali Datta (nee Kundu) , Debashis Mukherjee
Chemical Physics Letters 197 ( 3) 236 -242

84
1992
2
1992
Fock-space multireference coupled-cluster theory. fourth-order corrections to the ionization potential☆

Nayana Vaval , Keya B. Ghose , Sourav Pal , Debashis Mukherjee
Chemical Physics Letters 209 ( 3) 292 -298

26
1993
Development of a relaxation-inducing cluster expansion formalism for treating strong relaxation and correlation effects

Debasis Jana , Debashis Mukherjee
Journal of Chemical Physics 122 ( 23) 234101 -234101

15
2005
Some aspects of self-consistent propagator theories.

M. Durga Prasad , Sourav Pal , Debashis Mukherjee
Physical Review A 31 ( 3) 1287 -1298

28
1985
Molecular applications of coupled-cluster-based linear response theory: Inner and outer valence ionization potentials of nitrogen and water

Saroj K. Mukhopadhyay , Dhiman Sinha , M. Durga Prasad , Debashis Mukherjee
Chemical Physics Letters 117 ( 5) 437 -443

12
1985
199
1986
Molecular applications of open-shell coupled cluster theory for energy difference calculations: ionization and auger spectra of F2

Dhiman Sinha , Saroj Kr. Mukhopadhay , M.Durga Prasad , Debashis Mukherjee
Chemical Physics Letters 125 ( 3) 213 -217

46
1986
Multireference coupled-cluster methods using an incomplete model space: Application to ionization potentials and excitation energies of formaldehyde

Sourav Pal , Magnus Rittby , Rodney J. Bartlett , Dhiman Sinha
Chemical Physics Letters 137 ( 3) 273 -278

175
1987
A note on the direct calculation of excitation energies by quasi-degenerate MBPT and coupled-cluster theory

Dhiman Sinha , Saroj Mukhopadhyay , Debashis Mukherjee
Chemical Physics Letters 129 ( 4) 369 -374

145
1986