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Browsing by Author Mahapatra, U. S

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Issue DateTitleAuthor(s)
2002-07Accurate Calculations of Interstellar Lines of Mg+ Using the Coupled Cluster ApproachMajumder, S; Merlitz, H; Gopakumar, G; Das, B. P; Mahapatra, U. S; Mukherjee, Debashis
2011-08Application of an efficient multireference approach to free-base porphin and metalloporphyrins: Ground, excited, and positive ion statesChaudhuri, R. K; Freed, K. F; Chattopadhyay, S; Mahapatra, U. S
2008-12Application of improved virtual orbital based multireference methods to N2, LiF, and C4H6 systemsChattopadhyay, S; Chaudhuri, R. K; Mahapatra, U. S
2011-08Application of relativistic coupled cluster linear response theory to helium-like ions embedded in plasma environmentMadhulita Das; Chaudhuri, R. K; Chattopadhyay, S; Mahapatra, U. S; Mukherjee, P. K
2009-01Application of state-specific multireference Møller-Plesset perturbation theory to nonsinglet statesMahapatra, U. S; Chattopadhyay, S; Chaudhuri, R. K
2006-08Applications of core-valence extensive multi-reference coupled cluster theory and core-extensive coupled cluster-based linear response theoryNayak, M. K; Chaudhuri, R. K; Chattopadhyay, S; Mahapatra, U. S
2017-11Combined complete active space configuration interaction and perturbation theory applied to conformational energy prototypes: Rotation and inversion barriersSinha Ray, Suvonil; Mahapatra, U. S; Chaudhuri, R. K; Chattopadhyay, S
2001-02Core effects on ionization potentials in thalliumMerlitz, H; Gopakumar, G; Chaudhuri, R. K; Das, B. P; Mahapatra, U. S; Mukherjee, D
2002-09Electric dipole and quadrupole transition amplitudes for Ba+ using the relativistic coupled-cluster methodGopakumar, G; Merlitz, H; Chaudhuri, R. K; Das, B. P; Mahapatra, U. S; Mukherjee, D
2003-05-28Influence of correlation effects on the magnetic dipole hyperfine interaction in the low-lying states of Ca+Sahoo, B. K; Chaudhuri, R. K; Das, B. P; Majumder, S; Merlitz, H; Mahapatra, U. S; Mukherjee, D
2009-05-21Investigation of low-lying states of oxygen molecule via second-order multireference perturbation theory: a state-specific approachChattopadhyay, S; Mahapatra, U. S; Chaudhuri, R. K
2001-09Ionization potential and excitation energy calculations for Ba+ using the relativistic coupled-cluster methodGopakumar, G; Merlitz, H; Majumder, S; Chaudhuri, R. K; Das, B. P; Mahapatra, U. S; Mukherjee, D
2000-11Ionization potentials of beryllium-like ions from the relativistic coupled-cluster-based linear response theoryChaudhuri, R. K; Panda, P. K; Merlitz, H; Das, B. P; Mahapatra, U. S; Mukherjee, D
2003-10Magnetic dipole hyperfine interactions in 137Ba+ and the accuracies of the neutral weak interaction matrix elementsSahoo, B. K; Gopakumar, G; Chaudhuri, R. K; Das, B. P; Merlitz, H; Mahapatra, U. S; Mukherjee, D
2010-01Molecular applications of analytical gradient approach for the improved virtual orbital-complete active space configuration interaction methodChaudhuri, R. K; Chattopadhyay, S; Mahapatra, U. S; Freed, K. F
2008-07Molecular applications of state-specific multireference perturbation theory to HF, H/sub2O, H/sub 2S, C/sub 2, and N/sub 2 moleculesMahapatra, U. S; Chattopadhyay, S; Chaudhuri, R. K
2015-06Profiling the binding motif between Be and Mg in the ground state via a single-reference coupled cluster methodMahapatra, U. S; Banerjee, Debi; Chaudhuri, R. K; Chattopadhyay, S
2008-08Reappraisal of cis effect in 1,2-dihaloethenes: An improved virtual orbital multireference approachChaudhuri, R. K; Hammond, J. R; Freed, K. F; Chattopadhyay, S; Mahapatra, U. S
2013-11-27Reappraisal of Nuclear Quadrupole Moments of Atomic Halogens via Relativistic Coupled Cluster Linear Response Theory for the Ionization ProcessChaudhuri, R. K; Chattopadhyay, S; Mahapatra, U. S
2003-11Relativistic coupled cluster calculations of the energies for rubidium and cesium atomsChaudhuri, R. K; Sahoo, B. K; Das, B. P; Merlitz, H; Mahapatra, U. S; Mukherjee, D
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