Juan E. Peralta

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Gustavo E. ScuseriaWelch Professor of Chemistry, Physics & Astronomy, and Materials Science & NanoEngineeringE-mailová adresa ověřena na: rice.edu
Veronica BaroneDepartment of Physics - Central Michigan UniversityE-mailová adresa ověřena na: cmich.edu
Koblar JacksonProfessor of Physics, Central Michigan UniversityE-mailová adresa ověřena na: cmich.edu
Rajendra ZopeDepartment of Physics, University of Texas at El PasoE-mailová adresa ověřena na: utep.edu
Richard L MartinLos Alamos National LaboratoryE-mailová adresa ověřena na: lanl.gov
Rajendra P. JoshiPacific Northwest National LaboratoryE-mailová adresa ověřena na: cmich.edu
kushantha P. K. WithanageThe university of Texas at El PasoE-mailová adresa ověřena na: utep.edu
Yoh YamamotoAssistant Professor of Research, University of Texas at El PasoE-mailová adresa ověřena na: utep.edu
John P. PerdewTemple UniversityE-mailová adresa ověřena na: temple.edu
Juan Ignacio MeloResearcher at ConicetE-mailová adresa ověřena na: df.uba.ar
JC FacelliDistinguished Professor of Biomedical InformaticsE-mailová adresa ověřena na: utah.edu
Biswajit SantraSenior Scientist II, Schrödinger, Inc.E-mailová adresa ověřena na: schrodinger.com
Sebastian SchwalbeCenter for Advanced Systems Understanding (CASUS), GörlitzE-mailová adresa ověřena na: hzdr.de
Stephan P. A. SauerProfessor, Department of Chemistry, University of CopenhagenE-mailová adresa ověřena na: kiku.dk
Enrique R BatistaLos Alamos National LaboratoryE-mailová adresa ověřena na: lanl.gov
Jesse EickholtCentral Michigan UniversityE-mailová adresa ověřena na: cmich.edu
J. Karl Johnsonprofessor of chemcial engineering, university of pittsburghE-mailová adresa ověřena na: pitt.edu
Claudio Francisco TormenaChemistry Institute, Associate Professor, University of CampinasE-mailová adresa ověřena na: unicamp.br
Patricio F. ProvasiProfessor of physics, University of Northeastern - CONICETE-mailová adresa ověřena na: unne.edu.ar
Burak ÖzdemirPostdoctoral researcher at Università degli studi di Modena e Reggio EmiliaE-mailová adresa ověřena na: unimore.it

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Juan E. Peralta

Department of Physics and Science of Advanced Materials Program, Central Michigan University

E-mailová adresa ověřena na: cmich.edu - Domovská stránka

Electronic Structure Quantum Chemistry Computational Condensed Matter Materials Science Molecular Magnetism


Název Seřadit podle citací Seřadit podle roku Seřadit podle názvu	Citace Citace	Rok
Gaussian 09 Revision D. 01 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...	76821*	2014
Gaussian 16/Gaussian MJ Frisch Inc, 2016	6051*	2016
Energy band gaps and lattice parameters evaluated with the Heyd-Scuseria-Ernzerhof screened hybrid functional J Heyd, JE Peralta, GE Scuseria, RL Martin The Journal of chemical physics 123 (17), 2005	2052	2005
Enhanced half-metallicity in edge-oxidized zigzag graphene nanoribbons O Hod, V Barone, JE Peralta, GE Scuseria Nano letters 7 (8), 2295-2299, 2007	632	2007
Magnetic boron nitride nanoribbons with tunable electronic properties V Barone, JE Peralta Nano letters 8 (8), 2210-2214, 2008	373	2008
Angular dependence of spin–spin coupling constants RH Contreras, JE Peralta Progress in Nuclear Magnetic Resonance Spectroscopy 37 (4), 321-425, 2000	360	2000
Spin-orbit splittings and energy band gaps calculated with the Heyd-Scuseria-Ernzerhof screened hybrid functional JE Peralta, J Heyd, GE Scuseria, RL Martin Physical Review B—Condensed Matter and Materials Physics 74 (7), 073101, 2006	233	2006
Gaussian Inc 16, revision A. 03 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian Inc.: Wallingford, CT, 2016	211*	2016
Basis set dependence of NMR spin–spin couplings in density functional theory calculations: First row and hydrogen atoms JE Peralta, GE Scuseria, JR Cheeseman, MJ Frisch Chemical physics letters 375 (5-6), 452-458, 2003	200	2003
Edge effects in finite elongated graphene nanoribbons O Hod, JE Peralta, GE Scuseria Physical Review B—Condensed Matter and Materials Physics 76 (23), 233401, 2007	191	2007
DFT Calculation of NMR J_FF Spin−Spin Coupling Constants in Fluorinated Pyridines V Barone, JE Peralta, RH Contreras, JP Snyder The Journal of Physical Chemistry A 106 (23), 5607-5612, 2002	191	2002
Electronic properties of the biphenylene sheet and its one-dimensional derivatives MA Hudspeth, BW Whitman, V Barone, JE Peralta ACS nano 4 (8), 4565-4570, 2010	173	2010
Machine learning the voltage of electrode materials in metal-ion batteries RP Joshi, J Eickholt, L Li, M Fornari, V Barone, JE Peralta ACS applied materials & interfaces 11 (20), 18494-18503, 2019	152	2019
Lithium adsorption on zigzag graphene nanoribbons C Uthaisar, V Barone, JE Peralta Journal of Applied Physics 106 (11), 2009	147	2009
Accurate prediction of the electronic properties of low-dimensional graphene derivatives using a screened hybrid density functional V Barone, O Hod, JE Peralta, GE Scuseria Accounts of chemical research 44 (4), 269-279, 2011	134	2011
Substituent Effects on Scalar ²J(¹⁹F,¹⁹F) and ³J(¹⁹F,¹⁹F) NMR Couplings: A Comparison of SOPPA and DFT Methods V Barone, PF Provasi, JE Peralta, JP Snyder, SPA Sauer, RH Contreras The Journal of Physical Chemistry A 107 (23), 4748-4754, 2003	124	2003
Density functional investigations of the properties and thermochemistry of and using valence-electron and all-electron approaches ER Batista, RL Martin, PJ Hay, JE Peralta, GE Scuseria The Journal of chemical physics 121 (5), 2144-2150, 2004	118	2004
Hexagonal BC₃: A Robust Electrode Material for Li, Na, and K Ion Batteries RP Joshi, B Ozdemir, V Barone, JE Peralta The Journal of Physical Chemistry Letters 6 (14), 2728-2732, 2015	116	2015
Density functional theory study of optical transitions in semiconducting single-walled carbon nanotubes V Barone, JE Peralta, M Wert, J Heyd, GE Scuseria Nano letters 5 (8), 1621-1624, 2005	114	2005
Noncollinear magnetism in density functional calculations JE Peralta, GE Scuseria, MJ Frisch Physical Review B—Condensed Matter and Materials Physics 75 (12), 125119, 2007	112	2007

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