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Physical Chemistry Chemical Physics : PCCP|July 15, 2024
Understanding oxide ion transport in cation-ordered yttria-stabilized zirconiaSudeshna Madhual, P Padma KumarPhysical Chemistry Chemical Physics : PCCP|March 24, 2025
Molecular dynamics studies of oxide ion transport in Sr-doped LaFeO3: role of cationic environments and cooperativitySanjib Ray, P Padma KumarPhysical Chemistry Chemical Physics : PCCP|February 28, 2013
Influence of Si/P ordering on Na+ transport in NASICONsSupriya Roy, P Padma KumarThe Journal of Physical Chemistry. B|March 2, 2018
First-Principle Molecular Dynamics Investigation of Waterborne As-V SpeciesSangkha Borah, P Padma KumarPhysical Chemistry Chemical Physics : PCCP|May 17, 2016
Ab initio molecular dynamics investigation of structural, dynamic and spectroscopic aspects of Se(vi) species in the aqueous environmentSangkha Borah, P Padma KumarPhysical Chemistry Chemical Physics : PCCP|October 7, 2016
Ab initio molecular dynamics study of Se(iv) species in aqueous environmentSangkha Borah, P Padma KumarChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 30, 2025
Molecular Dynamics Investigations of the Melt-Quenched Phase of Mg-Doped Li-Rich Anti-PerovskiteSunil Kumar Moharana, P Padma KumarPhysical Chemistry Chemical Physics : PCCP|July 26, 2022
Understanding oxide ion transport in yttria stabilized zirconia: fresh insights from molecular dynamics simulationsSudeshna Madhual, Krishnanjan Pramanik, P Padma KumarPhysical Chemistry Chemical Physics : PCCP|October 6, 2020
Accessing slow diffusion in solids by employing metadynamics simulationKrishnanjan Pramanik, Sangkha Borah, P Padma KumarThe Journal of Chemical Physics|June 8, 2007
Dissociation of carbonic acid: gas phase energetics and mechanism from ab initio metadynamics simulationsP Padma Kumar, Andrey G Kalinichev, R James KirkpatrickPageof 3