Perfis

Huziel E. Sauceda

Assistant Professor, Instituto de Física, Universidad Nacional Autonoma de Mexico

E-mail confirmado em fisica.unam.mx

Citado por 7652

protected metal nanoparticles machine learning materials science nuclear quantum effects Machine learned force fields

Fabio Finocchi

Institut des NanoSciences de Paris (INSP), CNRS and Sorbonne Université

E-mail confirmado em insp.jussieu.fr

Citado por 4163

MaterialScience Nuclear Quantum Effects Surfaces & Interfaces First-Principles Molecular Dynamics

Wei Fang

Fudan University

E-mail confirmado em fudan.edu.cn

Citado por 1696

Molecular dynamics simulation density functional theory nuclear quantum effects reaction rate

Yang Yang

Assistant Professor at UW-Madison

E-mail confirmado em wisc.edu

Citado por 1514

Electronic Structure Density Functional Theory Nuclear Quantum Effects Excited States Theory Multicomponent Quantum Chemistr

Daniel Hollas

Post-doctoral Research Associate, Bristol University

E-mail confirmado em bristol.ac.uk

Citado por 1168

ab initio molecular dynamics non-adiabatic dynamics excited states nuclear quantum effects

Matthew Krzystyniak

Science and Technology Facilities Council

Citado por 934

nuclear quantum effects vibrational spectroscopy nuclear magnetic ressonance

Aran Lamaire

PhD student, Center for Molecular Modeling, Ghent University

E-mail confirmado em UGent.be

Citado por 576

Molecular Simulations Water Modelling Metal-Organic Frameworks Nuclear Quantum Effects Enhanced

Vibin Ipe Thomas

CMS College, Kottayam (af. Mahatma Gandhi University)

E-mail confirmado em cmscollege.ac.in

Citado por 501

Molecular Dynamics Nuclear Quantum effects Electronic Structure Theory Plasmonics

Christophe Vaillant

Quantistry

E-mail confirmado em quantistry.com

Citado por 408

nuclear quantum effects multiscale simulations chemical physics atomic and molecular physics molecular dynamics

Joseph E. Lawrence

New York University

E-mail confirmado em nyu.edu

Citado por 380

Theoretical Chemistry Chemical Physics Nuclear Quantum Effects Electron Transfer

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