Carlos Amador-Bedolla

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Alan Aspuru-GuzikProfessor of Chemistry and Computer Science, University of Toronto (starting July 1, 2018)Verified email at utoronto.ca
Roberto Olivares-AmayaVice President, Machine LearningVerified email at lifeminetx.com
Martha M Flores LeonarUniversity of TorontoVerified email at utoronto.ca
Leslie Vogt-MarantoDepartment of Chemistry (Tuckerman), New York UniversityVerified email at nyu.edu
Dr. Johannes HachmannAssociate Professor in the Department of Chemical and Biological Engineering, University at BuffaloVerified email at buffalo.edu
Roel S. Sanchez-Carrerawww.basf.comVerified email at gatech.edu
Sule Atahan-EvrenkTOBB University of Economics and Technology, Ankara, TurkiyeVerified email at etu.edu.tr
Kristin Aslaug Persson (nee Einarsdott...Department of Materials Science and Engineering, UC BerkeleyVerified email at berkeley.edu
Walter LambrechtPerkins Professor of Physics, Case Western Reserve UniversityVerified email at case.edu
Aryeh Gold-ParkerConsultant, Energy and Environmental EconomicsVerified email at ethree.com
Muratahan AykolGoogle DeepMindVerified email at google.com
Daniel P. TaborTexas A&M University (Department of Chemistry)Verified email at chem.tamu.edu
Benji MaruyamaAir Force Research LaboratoryVerified email at us.af.mil
Loïc M. RochChief Technology Officer & co-founder, Atinary TechnologiesVerified email at atinary.com
Shyam DwaraknathNoneVerified email at getcruise.com
Dennis SheberlaPostdoctoral Associate, Harvard UniversityVerified email at g.harvard.edu
Christoph J. BrabecFriedrich Alexander Universität Erlangen Nürnberg; Forschungszentrum JülichVerified email at fau.de
Christoph KreisbeckChief Executive OfficerVerified email at aixelo.com
Joseph MontoyaToyota Research InstituteVerified email at tri.global
Semion SaikinKebotix, Inc.Verified email at kebotix.com

Carlos Amador-Bedolla

Professor of Chemistry, Facultad de Química, Universidad Nacional Autónoma de México

Verified email at unam.mx

quantum chemistry energy


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The Harvard clean energy project: large-scale computational screening and design of organic photovoltaics on the world community grid J Hachmann, R Olivares-Amaya, S Atahan-Evrenk, C Amador-Bedolla, ... The Journal of Physical Chemistry Letters 2 (17), 2241-2251, 2011	750	2011
Accelerating the discovery of materials for clean energy in the era of smart automation DP Tabor, LM Roch, SK Saikin, C Kreisbeck, D Sheberla, JH Montoya, ... Nature reviews materials 3 (5), 5-20, 2018	746	2018
Accelerated computational discovery of high-performance materials for organic photovoltaics by means of cheminformatics R Olivares-Amaya, C Amador-Bedolla, J Hachmann, S Atahan-Evrenk, ... Energy & Environmental Science 4 (12), 4849-4861, 2011	222	2011
Accelerating resolution-of-the-identity second-order Møller− Plesset quantum chemistry calculations with graphical processing units L Vogt, R Olivares-Amaya, S Kermes, Y Shao, C Amador-Bedolla, ... The Journal of Physical Chemistry A 112 (10), 2049-2057, 2008	185	2008
Materials Acceleration Platforms: On the way to autonomous experimentation MM Flores-Leonar, LM Mejía-Mendoza, A Aguilar-Granda, ... Current Opinion in Green and Sustainable Chemistry 25, 100370, 2020	138	2020
Site occupancy of ternary additions to B2 alloys GH Bozzolo, RD Noebe, C Amador Intermetallics 10 (2), 149-159, 2002	121	2002
Materials Acceleration Platform: Accelerating Advanced Energy Materials Discovery by Integrating High-Throughput Methods with Artificial Intelligence A Aspuru-Guzik, K Persson, A Alexander-Katz, C Amador-Bedolla, ... Mission Innovation, 2018	111	2018
Application of generalized gradient-corrected density functionals to iron C Amador, WRL Lambrecht, B Segall Physical Review B 46 (3), 1870, 1992	95	1992
Theoretical and Experimental Study of Relaxations in Al_ {3} Ti and Al_ {3} Zr Ordered Phases C Amador, JJ Hoyt, BC Chakoumakos, D De Fontaine Physical review letters 74 (24), 4955-4958, 1995	78	1995
El origen de COVID-19: lo que se sabe, lo que se supone y (muy poquito) sobre las teorías de complot L Domínguez, C Amador-Bedolla Educación química 31 (2), 3-11, 2020	63	2020
Saliva is a reliable and accessible source for the detection of SARS-CoV-2 LA Herrera, A Hidalgo-Miranda, N Reynoso-Noverón, ... International Journal of Infectious Diseases 105, 83-90, 2021	61	2021
Further insights in DFT calculations of redox potential for iron complexes: The ferrocenium/ferrocene system MM Flores-Leonar, R Moreno-Esparza, VM Ugalde-Saldivar, ... Computational and Theoretical Chemistry 1099, 167-173, 2017	50	2017
Reassessment of the Four-Point Approach to the Electron-Transfer Marcus−Hush Theory O López-Estrada, HG Laguna, C Barrueta-Flores, C Amador-Bedolla ACS Omega 3 (2), 2130-2140, 2018	43	2018
An introduction to the BFS method and its use to model binary NiAl alloys G Bozzolo, RD Noebe, J Ferrante, C Amador Journal of computer-aided materials design 6, 1-32, 1999	43	1999
Modeling of the defect structure of {beta}-NiAl G Bozzolo, C Amador, J Ferrante, RD Noebe Scripta metallurgica et materialia 33 (12), 1995	37	1995
Band structures of Ni₃Pt and NiPt₃ A Pisanty, C Amador, Y Ruiz, M de la Vega Zeitschrift für Physik B Condensed Matter 80, 237-239, 1990	31	1990
Internal strain effects on the phase diagram of Ni-Pt alloys C Amador, WRL Lambrecht, M van Schilfgaarde, B Segall Physical Review B 47 (22), 15276, 1993	30	1993
" Wrong" Bond Interactions at Inversion Domain Boundaries in GaAs WRL Lambrecht, C Amador, B Segall Physical review letters 68 (9), 1363, 1992	27	1992
Electronic structure and nonlinear optical properties of organic photovoltaic systems with potential applications on solar cell devices: a DFT approach JM Alfredo Guillén‐López, Cornelio Delesma, Carlos Amador‐Bedolla, Miguel Robles Theoretical Chemistry Accounts 137, 85, 2018	26*	2018
Organic photovoltaics C Amador-Bedolla, R Olivares-Amaya, J Hachmann, A Aspuru-Guzik Informatics for Materials Science and Engineering, 423-442, 2013	24	2013

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