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Chemphyschem : 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 PalThe 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 PalInternational Journal of Molecular Sciences|August 27, 2021
Three-Body Excitations in Fock-Space Coupled-Cluster: Fourth Order Perturbation Correction to Electron Affinity and Its Relation to Bondonic FormalismSuhita Basumallick, Mihai V Putz, Sourav PalThe Journal of Physical Chemistry. A|September 27, 2013
Critical study of the charge transfer parameter for the calculation of interaction energy using the local hard-soft acid-base principleSusanta Das, Sapana V Shedge, Sourav PalJournal of Chemical Theory and Computation|December 3, 2015
Density Functional Static Dipole Polarizability and First-Hyperpolarizability Calculations of Nan (n = 2, 4, 6, 8) Clusters Using an Approximate CPKS Method and its Comparison with MP2 CalculationsK B Sophy, Patrizia Calaminici, Sourav PalThe Journal of Chemical Physics|February 2, 2015
A new scheme for perturbative triples correction to (0,1) sector of Fock space multi-reference coupled cluster method: theory, implementation, and examplesAchintya Kumar Dutta, Nayana Vaval, Sourav PalJournal of Chemical Theory and Computation|December 1, 2015
Calculation of Dipole Transition Matrix Elements and Expectation Values by Vibrational Coupled Cluster MethodSubrata Banik, Sourav Pal, M Durga PrasadPageof 13