Showing results (51-60 of 151) with videos related to
Sort By:
Pageof 16
The Journal of Chemical Physics|March 15, 2013
Electronic transition dipole moments and dipole oscillator strengths within Fock-space multi-reference coupled cluster framework: an efficient and novel approachDebarati Bhattacharya, Nayana Vaval, Sourav PalThe Journal of Chemical Physics|August 24, 2013
A Lagrange multiplier approach for excited state properties through intermediate Hamiltonian formulation of Fock space multireference coupled-cluster theoryJitendra Gupta, Nayana Vaval, Sourav PalPhysical Chemistry Chemical Physics : PCCP|December 3, 2015
Endohedrally doped gold nanocages: efficient catalysts for O2 activation and CO oxidationDar Manzoor, Sailaja Krishnamurty, Sourav PalJournal of Chemical Theory and Computation|November 26, 2015
Effect of Triples to Dipole Moments in Fock-Space Multireference Coupled Cluster MethodLalitha Ravichandran, Nayana Vaval, Sourav PalChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|February 14, 2024
Mechanistic Inquisition on the Reduction of C17Si(NH2)2 to NH3: A DFT StudySobitri Sen, Arijit Bag, Sourav PalInorganic Chemistry|July 8, 2026
Ligand-Induced Modulation of Photoluminescence in Atomically Precise Silver NanoclustersElizabeth Saji, Meghna Ghosh, Nida Nahan Eyyakkandy, et al.The Journal of Chemical Physics|December 3, 2008
Calculation of vibrational energy of molecule using coupled cluster linear response theory in bosonic representation: convergence studiesSubrata Banik, Sourav Pal, M Durga PrasadJournal of Chemical Theory and Computation|November 22, 2015
Performance of the EOMIP-CCSD(2) Method for Determining the Structure and Properties of Doublet Radicals: A Benchmark InvestigationAchintya Kumar Dutta, Nayana Vaval, Sourav PalJournal of Chemical Theory and Computation|November 24, 2015
NOx Catalyzed Pathway of Stratospheric Ozone Depletion: A Coupled Cluster InvestigationAchintya Kumar Dutta, Nayana Vaval, Sourav PalPhysical Chemistry Chemical Physics : PCCP|July 6, 2010
CDASE--a reliable scheme to explain the reactivity sequence between Diels-Alder pairsSoumen Saha, Ram Kinkar Roy, Sourav PalPageof 16