Roberto Car

Affiliations: 
Chemistry Princeton University, Princeton, NJ 
Area:
atomistic and the electronic structure and dynamics in materials
Website:
http://chemistry.princeton.edu/faculty/car
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"Roberto Car"
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Children

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Thomas Gregor research assistant 1998-2001 University of Geneva
Qiming Zhang grad student 1989 International School for Advanced Studies (SISSA) (Physics Tree)
Yudong Wu grad student 2004 Princeton
Manu Sharma grad student 2005 Princeton
Xiaofei Wang grad student 2005 Princeton
Yosuke Kanai grad student 2006 Princeton
Simone Piccinin grad student 2006 Princeton
Varadharajan Srinivasan grad student 2007 Princeton
Joseph A. Morrone grad student 2008 Princeton
Wei Chen grad student 2009 Princeton
Zhaofeng Li grad student 2012 Princeton
Lukas F Muechler grad student 2013-2018 Princeton
Xifan Wu post-doc Princeton (Physics Tree)
Olivier Parisel post-doc 1997 EPFL
Robert A. DiStasio Jr. post-doc 2009-2015 Princeton
Biswajit Santra post-doc 2012-2017 Princeton (Physics Tree)

Collaborators

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Xifan Wu collaborator Princeton (Physics Tree)
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Publications

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Tang F, Li Z, Zhang C, et al. (2022) Many-body effects in the X-ray absorption spectra of liquid water. Proceedings of the National Academy of Sciences of the United States of America. 119: e2201258119
Calegari Andrade MF, Ko HY, Zhang L, et al. (2020) Free energy of proton transfer at the water-TiO interface from deep potential molecular dynamics. Chemical Science. 11: 2335-2341
Piaggi PM, Car R. (2020) Phase equilibrium of liquid water and hexagonal ice from enhanced sampling molecular dynamics simulations. The Journal of Chemical Physics. 152: 204116
Sommers GM, Calegari Andrade MF, Zhang L, et al. (2020) Raman spectrum and polarizability of liquid water from deep neural networks. Physical Chemistry Chemical Physics : Pccp. 22: 10592-10602
Giannozzi P, Baseggio O, Bonfà P, et al. (2020) Quantum ESPRESSO toward the exascale. The Journal of Chemical Physics. 152: 154105
Ko HY, Jia J, Santra B, et al. (2020) Enabling Large-Scale Condensed-Phase Hybrid Density Functional Theory Based Molecular Dynamics I: Theory, Algorithm, and Performance. Journal of Chemical Theory and Computation
Zhang L, Chen M, Wu X, et al. (2020) Deep neural network for the dielectric response of insulators Physical Review B. 102
Muechler L, Hu W, Lin L, et al. (2020) Influence of point defects on the electronic and topological properties of monolayer WTe 2 Physical Review B. 102: 41103
Calegari Andrade MF, Ko H, Zhang L, et al. (2020) Free energy of proton transfer at the water–TiO2 interface from ab initio deep potential molecular dynamics Chemical Science. 11: 2335-2341
Galli G, Martin RM, Car R, et al. (2019) Structural and electronic properties of amorphous carbon. Physical Review Letters. 62: 555-558
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