Toward Chemical Accuracy in Predicting Enthalpies of Formation with General-Purpose Data-Driven Methods-Reference-Cited by-同舟云学术

Toward Chemical Accuracy in Predicting Enthalpies of Formation with General-Purpose Data-Driven Methods

Published:2022-04-13 Issue:15 Volume:13 Page:3479-3491
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Zheng Peikun¹^ORCID,Yang Wudi¹^ORCID,Wu Wei¹^ORCID,Isayev Olexandr²^ORCID,Dral Pavlo O.¹^ORCID

Affiliation:

1. State Key Laboratory of Physical Chemistry of Solid Surfaces, Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry, Department of Chemistry, and College of Chemistry and Chemical Engineering, Xiamen University, Xiamen 361005, China

2. Department of Chemistry, Carnegie Mellon University, Pittsburgh, Pennsylvania 15213, United States

Funder

Division of Chemistry

State Key Laboratory of Physical Chemistry of Solid Surfaces, Xiamen University

Central University Basic Research Fund of China

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.2c00734