Saswata Bhattacharya

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Pooja BaseraPostdoctoral Fellow, Institut des Sciences Chimiques de Rennes (ISCR) - UMR CNRS 6226Verified email at univ-rennes1.fr
G P. DasIndian Institute of Technology KharagpurVerified email at metal.iitkgp.ac.in
Manish KumarPostdoctoral Fellow, Institut für Physik, Humboldt-Universität zu BerlinVerified email at physik.hu-berlin.de
shikha sainiPostdoctoral Fellow, Stanford UniversityVerified email at stanford.edu
Dr. chiranjib majumderScientist, BARCVerified email at barc.gov.in
Luca M. GhiringhelliFritz-Haber-Institut der Max-Planck-GesellschaftVerified email at fhi-berlin.mpg.de
Arunima SinghResearch Scholar, Indian Institute of Technology DelhiVerified email at physics.iitd.ac.in
Preeti BhumlaResearch Scholar, Indian Institute of Technology DelhiVerified email at physics.iitd.ac.in
MANJARI JAINResearch Scholar, Department of Physics, Indian Institute of Technology Delhi, Hauz KhasVerified email at physics.iitd.ac.in
Sergey V. LevchenkoSkolkovo Institute of Science and Technology, Skolkovo Innovation Center, Moscow, RussiaVerified email at skoltech.ru
Deepika GillResearch Scholar, Department of Physics, IIT DelhiVerified email at iitd.ac.in
Sameer SapraIndian Institute of Science, LMU Munich, TU Dresden, Indian Institute of Technology Delhi, IIT DelhiVerified email at chemistry.iitd.ac.in
Matthias SchefflerDirector at Fritz-Haber-Institut der Max-Planck-GesellschaftVerified email at fhi-berlin.mpg.de
JP SinghIndian institute of technology DelhiVerified email at physics.iitd.ac.in
Venkata KrishnanAssociate Professor (Chemistry), IIT MandiVerified email at iitmandi.ac.in

Saswata Bhattacharya

Associate Professor, Department of Physics, Indian Institute of Technology Delhi, Hauz Khas

Verified email at physics.iitd.ac.in - Homepage

Condensed Matter Physics


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Report on the sixth blind test of organic crystal structure prediction methods AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016	445	2016
Transition-metal decoration enhanced room-temperature hydrogen storage in a defect-modulated graphene sheet A Bhattacharya, S Bhattacharya, C Majumder, GP Das The Journal of Physical Chemistry C 114 (22), 10297-10301, 2010	145	2010
Band gap engineering by functionalization of BN sheet A Bhattacharya, S Bhattacharya, GP Das Physical Review B 85 (3), 035415, 2012	130	2012
Stability and Metastability of Clusters in a Reactive Atmosphere: Theoretical Evidence for Unexpected Stoichiometries of S Bhattacharya, SV Levchenko, LM Ghiringhelli, M Scheffler Physical review letters 111 (13), 135501, 2013	85	2013
Third conformer of graphane: A first-principles density functional theory study A Bhattacharya, S Bhattacharya, C Majumder, GP Das Physical Review B 83 (3), 033404, 2011	77	2011
GAtor: a first-principles genetic algorithm for molecular crystal structure prediction F Curtis, X Li, T Rose, A Vazquez-Mayagoitia, S Bhattacharya, ... Journal of chemical theory and computation 14 (4), 2246-2264, 2018	74	2018
Band Gap Engineering in Cs₂(Na_xAg_1–x)BiCl₆ Double Perovskite Nanocrystals RS Lamba, P Basera, S Bhattacharya, S Sapra The Journal of Physical Chemistry Letters 10 (17), 5173-5181, 2019	68	2019
Strain-induced band-gap deformation of H/F passivated graphene and h-BN sheet A Bhattacharya, S Bhattacharya, GP Das Physical Review B 84 (7), 075454, 2011	51	2011
Hydrogen Storage in Ti-Decorated BC₄N Nanotube S Bhattacharya, C Majumder, GP Das The Journal of Physical Chemistry C 112 (45), 17487-17491, 2008	51	2008
Efficient ab initio schemes for finding thermodynamically stable and metastable atomic structures: benchmark of cascade genetic algorithms S Bhattacharya, SV Levchenko, LM Ghiringhelli, M Scheffler New Journal of Physics 16 (12), 123016, 2014	50	2014
Concepts and methods in modern theoretical chemistry: electronic structure and reactivity SK Ghosh, PK Chattaraj CRC Press, 2013	44	2013
A fast and effective approach for reversible wetting-dewetting transitions on ZnO nanowires K Yadav, BR Mehta, S Bhattacharya, JP Singh Scientific reports 6 (1), 1-9, 2016	40	2016
Exploring semiconductor substrates for silicene epitaxy A Bhattacharya, S Bhattacharya, GP Das Applied Physics Letters 103 (12), 123113, 2013	39	2013
Anti-Kubas type interaction in hydrogen storage on a Li decorated BHNH sheet: a first-principles based study S Bhattacharya, A Bhattacharya, GP Das The Journal of Physical Chemistry C 116 (5), 3840-3844, 2012	39	2012
Unraveling the structural and morphological stability of oxygen vacancy engineered leaf-templated CaTiO 3 towards photocatalytic H 2 evolution and N 2 fixation reactions A Kumar, M Kumar, VN Rao, MV Shankar, S Bhattacharya, V Krishnan Journal of Materials Chemistry A 9 (31), 17006-17018, 2021	36	2021
Formation of water chains on CaO (001): What drives the 1D growth? X Zhao, X Shao, Y Fujimori, S Bhattacharya, LM Ghiringhelli, HJ Freund, ... The Journal of Physical Chemistry Letters 6 (7), 1204-1208, 2015	32	2015
First principles prediction of the third conformer of hydrogenated BN sheet A Bhattacharya, S Bhattacharya, C Majumder, GP Das Phys. Status Solidi RRL 4 (12), 368 - 370, 2010	32	2010
Ti-Decorated BC₄N Sheet: A planar Nanostructure for High-Capacity Hydrogen Storage S Bhattacharya, C Majumder, GP Das The Journal of Physical Chemistry C 113 (36), 15783-15787, 2009	32	2009
Theoretical evidence for unexpected O-rich phases at corners of MgO surfaces S Bhattacharya, D Berger, K Reuter, LM Ghiringhelli, SV Levchenko Physical Review Materials 1 (7), 071601, 2017	30	2017
Tuning the wettability of indium oxide nanowires from superhydrophobic to nearly superhydrophilic: Effect of oxygen-related defects K Yadav, BR Mehta, KV Lakshmi, S Bhattacharya, JP Singh The Journal of Physical Chemistry C 119 (28), 16026-16032, 2015	30	2015

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