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Issue Date
Title
Author(s)
2011-10
Ab Initio Multireference Investigation of Disjoint Diradicals: Singlet versus Triplet Ground States
Chattopadhyay, Sudip
;
Chaudhuri, R. K
;
Mahapatra, Uttam Sinha
2019-02-15
Multireference perturbation theory with improved virtualorbitals for radicals: More degeneracies, more problems
Ray, S. S
;
Manna, S
;
Ghosh, Anirban
;
Chaudhuri, R. K
;
Chattopadhyay, Sudip
Discover
Author
2
Chattopadhyay, Sudip
2
Chaudhuri, R. K
1
Ghosh, Anirban
1
Mahapatra, Uttam Sinha
1
Manna, S
1
Ray, S. S
Subject
1
Ab initio calculations
1
Computational chemistry
1
Correlation energies
1
Electronic structures
1
Energy gaps
1
Improved virtual orbitals
1
Multireference perturbation theory
1
Statespecific method
Date issued
1
2011
1
2019
Has File(s)
2
true