Intensive Atomization Energy: Re-Thinking a Metric for Electronic Structure Theory Methods
Journal Article
·
· Zeitschrift fuer Physikalische Chemie
Abstract The errors in atomization energies (
- Research Organization:
- Energy Frontier Research Centers (EFRC) (United States). Center for the Computational Design of Functional Layered Materials (CCDM)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- DOE Contract Number:
- SC0012575
- OSTI ID:
- 1371107
- Journal Information:
- Zeitschrift fuer Physikalische Chemie, Vol. 230, Issue 5-7; Related Information: CCDM partners with Temple University (lead); Brookhaven National Laboratory; Drexel University; Duke University; North Carolina State University; Northeastern University; Princeton University; Rice University; University of Pennsylvania; ISSN 0942-9352
- Publisher:
- de Gruyter
- Country of Publication:
- United States
- Language:
- English
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