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Results 1-10 of 19 (Search time: 0.005 seconds).
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Issue DateTitleAuthor(s)
2001-08Characterization of the bent F-state of the CaOh radical by the H-vChaudhuri, R. K; Freed, K. F; Abrash, S. A; Potts, D. M
2000-06Determination of conformational energy differences of propynlidyne isomers using the effective valence shell Hamiltonian methodChaudhuri, R. K; Majumder, S; Freed, K. F
2008-04Potential energy curve for isomerization of N2H2 and C2H4 using the improved virtual orbital multireference Møller–Plesset perturbation theoryChaudhuri, R. K; Freed, K. F; Chattopadhyay, S; Sinha Mahapatra, U
2007-03Geometry optimization using improved virtual orbitals: A complete active space numerical gradient approachChaudhuri, R. K; Freed, K. F
2006-08Ab initio description of the ground and excited states of cyanogen isomersChaudhuri, R. K; Krishnamachari, S. L. N. G; Freed, K. F
1998-02Application of the effective valence shell Hamiltonian method to accurate estimation of oscillator strengths and excitation energies of Mg-like ionsChaudhuri, R. K; Das, B. P; Freed, K. F
1998-12Evaluation of analytic molecular orbital derivatives and gradients using the effective valence shell Hamiltonian methodChaudhuri, R. K; Stevens, J. E; Freed, K. F
2005-10Quadratic Padé approximants and the intruder state problem of multireference perturbation methodsPerrine, T. M; Chaudhuri, R. K; Freed, K. F
2003-09-22A critical analysis of the ground and excited electronic states of transition metal nitrides using the relativistic effective Hamiltonian methodChaudhuri, R. K; Freed, K. F
2005-05Relativistic effective valence shell Hamiltonian method: Excitation and ionization energies of heavy metal atomsChaudhuri, R. K; Freed, K. F