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- Sourav_Pal abstract "Sourav Pal is one of the pioneers in the area of quantum chemistry. Pal is director of National Chemical Laboratory, and adjunct professor at the Indian Institute of Science Education and Research, both in Pune.He is one of the leaders in the response properties using coupled cluster based methods. His major scientific accomplishments include rigorous development of expectation value as well as extended coupled-cluster functional retaining size-extensivity of analytic properties, pioneering development of the response properties to multi-reference coupled cluster (MRCC) theory, important applications of the theory to spectra, study of the effect of electron correlation and role of exchange effects on the low energy electron molecule scattering, introduction of complex scaling and complex absorbing potential in MRCC theory to calculate electron-atom and electron-molecule resonances accurately. He has developed a non-iterative approximation to coupled-perturbed Kohn-Sham density functional theoretic equations for calculation of non-linear properties, which is implemented in the developers’ version of deMon code.Dr. Sourav Pal has also made significant contributions in the area of reactivity descriptors highlighting the conditions of validity of the principle of maximum hardness, deriving qualitative relation of hardness with polarizability, establishing Hirshfeld population in calculation of condensed Fukui functions and developing local hard-soft-acid-base principle for molecular recognition. Further, among his major scientific contributions is study of anti-aromaticity in metal clusters using ab initio molecular dynamics (AIMD) study of structure, electron localisation function and magnetic ring currents. He has addressed the incorporation of Sn-into Beta Zeolites theoretically using AIMD and is actively engaged in computational study of hydrogen storage properties of materials.".
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- Sourav_Pal wikiPageWikiLink Ab_initio.
- Sourav_Pal wikiPageWikiLink American_Physical_Society.
- Sourav_Pal wikiPageWikiLink Category:Indian_chemists.
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- Sourav_Pal wikiPageWikiLink Category:Recipients_of_the_Shanti_Swarup_Bhatnagar_Award_in_Chemical_Science.
- Sourav_Pal wikiPageWikiLink Coupled_cluster.
- Sourav_Pal wikiPageWikiLink Debashis_Mukherjee.
- Sourav_Pal wikiPageWikiLink Expected_value.
- Sourav_Pal wikiPageWikiLink Fukui_function.
- Sourav_Pal wikiPageWikiLink Indian_Academy_of_Sciences.
- Sourav_Pal wikiPageWikiLink Indian_Association_for_the_Cultivation_of_Science.
- Sourav_Pal wikiPageWikiLink Indian_Institute_of_Technology_Kanpur.
- Sourav_Pal wikiPageWikiLink Indian_Institutes_of_Science_Education_and_Research.
- Sourav_Pal wikiPageWikiLink Indian_National_Science_Academy.
- Sourav_Pal wikiPageWikiLink National_Chemical_Laboratory.
- Sourav_Pal wikiPageWikiLink Pune.
- Sourav_Pal wikiPageWikiLink Quantum_chemistry.
- Sourav_Pal wikiPageWikiLink Rodney_J._Bartlett.
- Sourav_Pal wikiPageWikiLink Shanti_Swarup_Bhatnagar_Prize_for_Science_and_Technology.
- Sourav_Pal wikiPageWikiLink Slater_determinant.
- Sourav_Pal wikiPageWikiLink The_National_Academy_of_Sciences,_India.
- Sourav_Pal name "Pal, Sourav".
- Sourav_Pal shortDescription "Indian chemist".
- Sourav_Pal wikiPageUsesTemplate Template:Autobiography.
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- Sourav_Pal description "Indian chemist".
- Sourav_Pal description "Indian chemist".
- Sourav_Pal subject Category:Indian_chemists.
- Sourav_Pal subject Category:Living_people.
- Sourav_Pal subject Category:Recipients_of_the_Shanti_Swarup_Bhatnagar_Award_in_Chemical_Science.
- Sourav_Pal hypernym Pioneers.
- Sourav_Pal type Agent.
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- Sourav_Pal comment "Sourav Pal is one of the pioneers in the area of quantum chemistry. Pal is director of National Chemical Laboratory, and adjunct professor at the Indian Institute of Science Education and Research, both in Pune.He is one of the leaders in the response properties using coupled cluster based methods.".
- Sourav_Pal label "Sourav Pal".
- Sourav_Pal sameAs Q7565099.
- Sourav_Pal sameAs m.0ch42h0.
- Sourav_Pal sameAs Q7565099.
- Sourav_Pal wasDerivedFrom Sourav_Pal?oldid=665369879.
- Sourav_Pal givenName "Sourav".
- Sourav_Pal homepage spalhomepage.html.
- Sourav_Pal isPrimaryTopicOf Sourav_Pal.
- Sourav_Pal name "Pal, Sourav".
- Sourav_Pal name "Sourav Pal".
- Sourav_Pal surname "Pal".