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Showing 10 out of a total of 132 results for community: IIAP Publications.
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Study of equilibrium geometries of diradicaloid systems via state specific multireference Moller-Plesset perturbation theory (SS-MRMPPT)
Chattopadhyay, S
;
Mahapatra, U. S
;
Chaudhuri, R. K
(
Elsevier
,
2010-03
)
Valence universal multireference coupled cluster calculations of the properties of indium in its ground and excited states
Madhulita Das
;
Chaudhuri, R. K
;
Chattopadhyay, S
;
Mahapatra, U. S
(
IOP Publishing
,
2011-03
)
Determination of molecular hyperfine-structure constant using the second-order relativistic many-body perturbation theory
Nayak, M. K
;
Chaudhuri, R. K
(
American Physical Society
,
2011-02
)
Study of isolated 1 : 1 AI+3.He complex using many-body perturbation theory: A multi-reference approach
Chattopadhyay, S
;
Mahapatra, U. S
;
Chaudhuri, R. K
(
Indian Association for the Cultivation of Science
,
2007-10
)
Theoretical Studies of the Ground and Excited State Structures of Stilbene
Chaudhuri, R. K
;
Freed, K. F
;
Chattopadhyay, S
;
Mahapatra, U. S
(
American Chemical Society
,
2013-10-03
)
Study of the ground state dissociation of diatomic molecular systems using state-specific multireference perturbation theory: a Brillouin-Wigner scheme
Mahapatra, U. S
;
Chattopadhyay, S
;
Chaudhuri, R. K
(
American Chemical Society
,
2010-03
)
Second-order state-specific multireference moller-plesset perturbation theory (SS-MRMPPT) applied to geometry optimization
Mahapatra, U. S
;
Chattopadhyay, S
;
Chaudhuri, R. K
(
American Chemical Society
,
2010-03-18
)
Molecular applications of analytical gradient approach for the improved virtual orbital-complete active space configuration interaction method
Chaudhuri, R. K
;
Chattopadhyay, S
;
Mahapatra, U. S
;
Freed, K. F
(
American Institute of Physics
,
2010-01
)
Second-order state-specific multireference Møller Plesset perturbation theory: Application to energy surfaces of diimide, ethylene, butadiene, and cyclobutadiene
Mahapatra, U. S
;
Chattopadhyay, S
;
Chaudhuri, R. K
(
John Wiley & Sons, Inc
,
2011-01
)
Studies on m-benzyne and phenol via improved virtual orbital-complete active space configuration interaction (IVO-CASCI) analytical gradient method
Chattopadhyay, S
;
Chaudhuri, R. K
;
Mahapatra, U. S
(
Elsevier
,
2010-05
)
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Chaudhuri, R. K (132)
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