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Showing 9 out of a total of 19 results for community: IIAP Publications.
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Electronic structure of the calcium monohydroxide radical
Taylor, C. M
;
Chaudhuri, R. K
;
Freed, K. F
(
American Institute of Physics
,
2005-01
)
Comparison of low-order multireference many-body perturbation theories
Chaudhuri, R. K
;
Freed, K. F
;
Hose, G
;
Piecuch, P
;
Kowalski, K
;
Wloch, M
;
Chattopadhyay, S
;
Mukherjee, D
;
Rolik, Z
;
Szabados, A
;
Tóth, G
;
Surján, P. R
(
American Institute of Physics
,
2005-04
)
Reappraisal of cis effect in 1,2-dihaloethenes: An improved virtual orbital multireference approach
Chaudhuri, R. K
;
Hammond, J. R
;
Freed, K. F
;
Chattopadhyay, S
;
Mahapatra, U. S
(
American Institute of Physics
,
2008-08
)
Generation of potential energy curves for the X-1Sigma (+) g, B-1 Delta (+) (g), and B' (1) states of C-2 using the effective valence shell Hamiltonian method
Chaudhuri, R. K
;
Freed, K. F
(
American Institute of Physics
,
2005-04
)
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
)
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
)
Theoretical aids in screening candidates for atomic clocks: Illustration for Yb II
Chaudhuri, R. K
;
Freed, K. F
;
Chattopadhyay, S
;
Mahapatra, U. S
(
IOP Publishing
,
2012-04
)
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
)
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
)
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Author
Chaudhuri, R. K (19)
Freed, K. F (19)
Chattopadhyay, S (8)
Mahapatra, U. S (5)
Abrash, S. A (1)
Das, B. P (1)
Hammond, J. R (1)
Hose, G (1)
Kowalski, K (1)
Krishnamachari, S. L. N. G (1)
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Subject
Excited States (6)
Ground States (5)
Perturbation Theory (5)
Organic Compounds (4)
Potential Energy Surfaces (4)
HF Calculations (3)
Oscillator Strengths (3)
Ab initio calculations (2)
Excited states (2)
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Date Issued
2010 - 2013 (5)
2000 - 2009 (12)
1998 - 1999 (2)
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