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Issue Date
Title
Author(s)
2008-11-18
A noniterative perturbative triples correction for the spin-flipping and spin-conserving equation-of-motion coupled-cluster methods with single and double substitutions
Manohar, Prashant Uday
2007-12-03
Constrained Variational Response to Fock‐Space Multi‐Reference Coupled‐Cluster Theory: Formulation for Excited‐State Electronic Structure Calculations and Some Pilot Applications
Manohar, Prashant Uday
2009-06
First- and second-order electrical properties computed at the FSMRCCSD level for excited states of closed-shell molecules using the constrained-variational approach
Manohar, Prashant Uday
2009-09-18
Perturbative triples correction for the equation-of-motion coupled-cluster wave functions with single and double substitutions for ionized states: Theory, implementation, and examples
Manohar, Prashant Uday
2007
Analytical Dipole Moments and Dipole Polarizabilities of Oxygen Mono-Fluoride and Nitrogen Dioxide: A Constrained Variational Response to Fock-Space Multi-Reference Coupled-Cluster Method
Manohar, Prashant Uday
2007-04
Dipole moments and polarizabilities of some small radicals using constrained variational response to Fock-space multi-reference coupled-cluster theory
Manohar, Prashant Uday
2006-08
Constrained variational response to Fock-space multi-reference coupled-cluster theory: Some pilot applications
Manohar, Prashant Uday
2005
Electronic Spectra and Ionization Potentials of Halogen Oxides Using the Fock Space Coupled-Cluster Method
Manohar, Prashant Uday
2004-04
Extended coupled-cluster approach for magnetizabilities of small molecules
Manohar, Prashant Uday
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Coupled-cluster
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Constrained variation
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Coupled-cluster theory
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Coupled‐Cluster Theory
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Dipole
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FSMRCCSD level
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Halogen monoxides
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2007
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