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Showing 10 out of a total of 132 results for community: IIAP Publications.
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Revisiting the ‘cis-effect’ in 1,2-difluoro derivatives of ethylene and diazene using ab initio multireference methods
Banerjee, Debi
;
Ghosh, Anirban
;
Chattopadhyay, Sudip
;
Ghosh, Pradipta
;
Chaudhuri, R. K
(
Taylor & Francis
,
2014-12
)
Taming the Electronic Structure of Lead and Eka-lead (Flerovium) by the Relativistic Coupled Cluster Method
Chaudhuri, R. K
;
Chattopadhyay, S
;
Mahapatra, U. S
(
American Chemical Society
,
2013-09-12
)
Electronic structure reference calculations for designing and interpreting P and T violation experiments
Nayak, M. K
;
Chaudhuri, R. K
(
John Wiley & Sons Inc.,
,
2008
)
Application of an efficient multireference approach to free-base porphin and metalloporphyrins: Ground, excited, and positive ion states
Chaudhuri, R. K
;
Freed, K. F
;
Chattopadhyay, S
;
Mahapatra, U. S
(
American Institute of Physics
,
2011-08
)
Application of relativistic coupled cluster linear response theory to helium-like ions embedded in plasma environment
Madhulita Das
;
Chaudhuri, R. K
;
Chattopadhyay, S
;
Mahapatra, U. S
;
Mukherjee, P. K
(
IOP Publishing
,
2011-08
)
Fock-space multireference coupled-cluster calculations of the hyperfine structure of isoelectronic 33S− and 35,37Cl
Madhulita Das
;
Chaudhuri, R. K
;
Chattopadhyay, Sudip
;
Mahapatra, Uttam Sinha
(
American Physical Society
,
2011-10
)
Geometry Optimization of Radicaloid Systems Using Improved Virtual Orbital-Complete Active Space Configuration Interaction (IVO-CASCI) Analytical Gradient Method
Chattopadhyay, S
;
Chaudhuri, R. K
;
Freed, K. F
(
American Chemical Society
,
2011-04
)
Prediction of electronic structure of organic radicaloid anions using efficient, economical multireference gradient approach
Chattopadhyay, Sudip
;
Chaudhuri, R. K
;
Freed, Karl F
(
Royal Society of Chemistry Publishing
,
2011-04
)
Description of C2 dissociation using a naive treatment of dynamical correlation in the presence of quasidegeneracy of varying degree
Ray, S. S
;
Manna, S
;
Chaudhuri, R. K
;
Chattopadhyay, S
(
Taylor & Francis
,
2017-05-19
)
Taming the Electronic Structure of Diradicals through the Window of Computationally Cost Effective Multireference Perturbation Theory
Sinha Ray, Suvonil
;
Ghosh, A
;
Chattopadhyay, S
;
Chaudhuri, R. K
(
American Chemical Society
,
2016-07-28
)
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Chaudhuri, R. K (132)
Chattopadhyay, S (43)
Das, B. P (40)
Mukherjee, D (36)
Mahapatra, U. S (35)
Sahoo, B. K (31)
Freed, K. F (19)
Majumder, S (14)
Sur, C (13)
Chattopadhyay, Sudip (11)
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Atomic Physics (11)
Perturbation Theory (9)
Excited States (8)
Ground States (7)
Excited states (6)
Multireference perturbation theory (6)
Organic Compounds (6)
Potential Energy Surfaces (6)
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2020 - 2023 (6)
2010 - 2019 (42)
2000 - 2009 (79)
1998 - 1999 (5)
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