Predicting Structural Properties of Pure Silica Zeolites Using Deep Neural Network Potentials

Sours, Tyler G.; Kulkarni, Ambarish R.

doi:10.1021/acs.jpcc.2c08429

Predicting Structural Properties of Pure Silica Zeolites Using Deep Neural Network Potentials

Journal Article · 12 January 2023 · Journal of Physical Chemistry. C

DOI:https://doi.org/10.1021/acs.jpcc.2c08429· OSTI ID:2423058

Sours, Tyler G. ^[1]; ^[1]

Department of Chemical Engineering, University of California, Davis, Davis, California95616, United States

Not provided.

Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC)

Sponsoring Organization:: USDOE

DOE Contract Number:: AC02-05CH11231

OSTI ID:: 2423058

Journal Information:: Journal of Physical Chemistry. C, Journal Name: Journal of Physical Chemistry. C Journal Issue: 3 Vol. 127; ISSN 1932-7447

Publisher:: American Chemical Society

Country of Publication:: United States

Language:: English

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