Santanu Chaudhuri

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Clare P. GreyYusuf Hamied Department of Chemistry, University of CambridgeVerified email at cam.ac.uk
Kaushik JoshiResearch Associate, University of VirginiaVerified email at virginia.edu
Jason GraetzBrookhaven, HRLVerified email at alumni.caltech.edu
Yves Jean ChabalUniversity of Texas at DallasVerified email at utdallas.edu
Wenbo DuRescaleVerified email at rescale.com
Peter ChupasAmes National LaboratoryVerified email at ameslab.gov
H. Shaun KwakApplications Lead, Schrödinger Inc.Verified email at schrodinger.com
Dirtha SanyalVariable Energy Cyclotron Centre, HBNIVerified email at vecc.gov.in
Hui FangAssociate Professor, Dartmouth CollegeVerified email at dartmouth.edu
D. Scott StewartProfessor of Theoretical and Applied Mechanics, University of Illinois, Professor of MechanicalVerified email at illinois.edu
Thomas VogtUniversity of South CarolinaVerified email at mailbox.sc.edu
John B. PariseStony brook UniversityVerified email at stonybrook.edu
Simon J. L. BillingeColumbia University and Brookhaven National LaboratoryVerified email at columbia.edu
Richard KanerUniversity of California, Los AngelesVerified email at chem.ucla.edu
Yue WangAssistant Professor, University of California, MercedVerified email at ucmerced.edu
Benjamin J. MorganDepartment of Chemistry, University of BathVerified email at bath.ac.uk
Boris B AverkievKansas State UniversityVerified email at ksu.edu
Michelle L PantoyaTexas Tech UniversityVerified email at ttu.edu
Sylvie RanganAssistant Research ProfessorVerified email at physics.rutgers.edu
Adri van DuinDistinguished Professor of Mechanical Engineering, Penn State UniversityVerified email at psu.edu

Santanu Chaudhuri

Professor of Materials Engineering, University of Illinois at Chicago and Argonne National Lab

Verified email at uic.edu - Homepage

Multiscale Materials Modeling Molecular Dynamics Density Functional Theory Chemical Kinetics.


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Ultrathin, transferred layers of thermally grown silicon dioxide as biofluid barriers for biointegrated flexible electronic systems H Fang, J Zhao, KJ Yu, E Song, AB Farimani, CH Chiang, X Jin, Y Xue, ... Proceedings of the National Academy of Sciences 113 (42), 11682-11687, 2016	199	2016
Understanding the role of Ti in reversible hydrogen storage as sodium alanate: a combined experimental and density functional theoretical approach S Chaudhuri, J Graetz, A Ignatov, JJ Reilly, JT Muckerman Journal of the American Chemical Society 128 (35), 11404-11415, 2006	155	2006
First-Principles Study of Ti-Catalyzed Hydrogen Chemisorption on an Al Surface: A Critical First Step for Reversible Hydrogen Storage in NaAlH₄ S Chaudhuri, JT Muckerman The Journal of Physical Chemistry B 109 (15), 6952-6957, 2005	153	2005
Predictive modeling of localized corrosion: An application to aluminum alloys J Xiao, S Chaudhuri Electrochimica Acta 56 (16), 5630-5641, 2011	139	2011
Pressure-induced structural and electronic changes in J Graetz, S Chaudhuri, Y Lee, T Vogt, JT Muckerman, JJ Reilly Physical Review B 74 (21), 214114, 2006	96	2006
Direct and Reversible Synthesis of AlH₃−Triethylenediamine from Al and H₂ J Graetz, S Chaudhuri, J Wegrzyn, Y Celebi, JR Johnson, W Zhou, ... The Journal of Physical Chemistry C 111 (51), 19148-19152, 2007	84	2007
Theoretical study of elementary steps in the reactions between aluminum and teflon fragments under combustive environments M Losada, S Chaudhuri The Journal of Physical Chemistry A 113 (20), 5933-5941, 2009	83	2009
Design of anti-icing coatings using supercooled droplets as nano-to-microscale probes J Xiao, S Chaudhuri Langmuir 28 (9), 4434-4446, 2012	81	2012
Probing local and long-range structure simultaneously: An in situ study of the high-temperature phase transition of α-AlF3 PJ Chupas, S Chaudhuri, JC Hanson, X Qiu, PL Lee, SD Shastri, ... Journal of the American Chemical Society 126 (15), 4756-4757, 2004	79	2004
Resolving the different dynamics of the fluorine sublattices in the anionic conductor BaSnF4 by using high-resolution MAS NMR techniques S Chaudhuri, F Wang, CP Grey Journal of the American Chemical Society 124 (39), 11746-11757, 2002	63	2002
Turning aluminium into a noble-metal-like catalyst for low-temperature activation of molecular hydrogen IS Chopra, S Chaudhuri, JF Veyan, YJ Chabal Nature materials 10 (11), 884-889, 2011	51	2011
Graphene-assisted solution growth of vertically oriented organic semiconducting single crystals Y Wang, JA Torres, AZ Stieg, S Jiang, MT Yeung, Y Rubin, S Chaudhuri, ... ACS nano 9 (10), 9486-9496, 2015	50	2015
An atomistic MD simulation and pair-distribution-function study of disorder and reactivity of α-AlF 3 nanoparticles S Chaudhuri, P Chupas, BJ Morgan, PA Madden, CP Grey Physical Chemistry Chemical Physics 8 (43), 5045-5055, 2006	43	2006
Polyoligomeric silsesquioxane (POSS)–hydrogenated polybutadiene polyurethane coatings for corrosion inhibition of AA2024 G Markevicius, S Chaudhuri, C Bajracharya, R Rastogi, J Xiao, C Burnett, ... Progress in Organic Coatings 75 (4), 319-327, 2012	41	2012
Effect of A-site cation radius on ordering of BX₆ octahedra in (K,Na)MgF₃ perovskite CD Martin, S Chaudhuri, CP Grey, JB Parise American Mineralogist 90 (10), 1522-1533, 2005	39	2005
Study of the nature and mechanism of the rhombohedral-to-cubic phase transition in α-AlF3 with molecular dynamics simulations S Chaudhuri, PJ Chupas, M Wilson, P Madden, CP Grey The Journal of Physical Chemistry B 108 (11), 3437-3445, 2004	39	2004
Reactive simulation of the chemistry behind the condensed-phase ignition of RDX from hot spots KL Joshi, S Chaudhuri Physical Chemistry Chemical Physics 17 (28), 18790-18801, 2015	38	2015
Density functional theory calculations of pressure effects on the structure and vibrations of 1, 1-diamino-2, 2-dinitroethene (FOX-7) BB Averkiev, ZA Dreger, S Chaudhuri The Journal of Physical Chemistry A 118 (43), 10002-10010, 2014	38	2014
Dynamic effects in MAS and MQMAS NMR spectra of half-integer quadrupolar nuclei: Calculations and an application to the double perovskite cryolite M Kotecha, S Chaudhuri, CP Grey, L Frydman Journal of the American Chemical Society 127 (47), 16701-16712, 2005	37	2005
Mirrored continuum and molecular scale simulations of the ignition of high-pressure phases of RDX K Lee, K Joshi, S Chaudhuri, DS Stewart The Journal of chemical physics 144 (18), 2016	31	2016

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