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Fingerprint Fingerprint is based on mining the text of the experts' scientific documents to create an index of weighted terms, which defines the key subjects of each individual researcher.

  • 13 Similar Profiles
molecular dynamics Physics & Astronomy
Molecular dynamics Chemical Compounds
Density functional theory Chemical Compounds
electronics Physics & Astronomy
Electronic properties Chemical Compounds
Atoms Chemical Compounds
liquids Physics & Astronomy
Electronic structure Chemical Compounds

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Research Output 1975 2019

1 Citation (Scopus)

Active learning of uniformly accurate interatomic potentials for materials simulation

Zhang, L., Lin, D. Y., Wang, H., Car, R. & E, W., Feb 25 2019, In : Physical Review Materials. 3, 2, 023804.

Princeton University

Research output: Contribution to journalArticle

Potential energy surfaces
Molecular modeling
Learning systems
Problem-Based Learning

Reliable and practical computational description of molecular crystal polymorphs

Hoja, J., Ko, H. Y., Neumann, M. A., Car, R., DiStasio, R. A. & Tkatchenko, A., Jan 1 2019, In : Acta Horticulturae Sinica. 45, 12, eaau3338.

Princeton University

Research output: Contribution to journalArticle

crystals
crystal structure
prediction
energy
drugs
7 Citations (Scopus)

DeePCG: Constructing coarse-grained models via deep neural networks

Zhang, L., Han, J., Wang, H., Car, R. & Weinan, W. E., Jul 21 2018, In : Journal of Chemical Physics. 149, 3, 034101.

Princeton University

Research output: Contribution to journalArticle

Oxygen
oxygen
Molecular dynamics
Deep neural networks
molecular dynamics
43 Citations (Scopus)

Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics

Zhang, L., Han, J., Wang, H., Car, R. & E, W., Apr 4 2018, In : Physical review letters. 120, 14, 143001.

Princeton University

Research output: Contribution to journalArticle

quantum mechanics
molecular dynamics
interatomic forces
costs
symmetry

Press/Media

PREDICTING A NEW PHASE OF SUPERIONIC ICE

Roberto Car

3/14/18

1 item of media coverage

Princeton University

Press/Media: Press / Media

Simulations solve 200-year-old ionic mystery of water

Roberto Car

3/14/18

1 item of media coverage

Princeton University

Press/Media: Press / Media

Big steps toward control of production of tiny building blocks

Bruce E. Koel & Roberto Car

3/8/183/9/18

2 items of media coverage

Princeton University

Press/Media: Press / Media

Big Steps Toward Control of Production of Tiny Building Blocks

Roberto Car & Bruce E. Koel

3/6/183/8/18

3 items of media coverage

Princeton University

Press/Media: Press / Media