Materials Data on MoPb3Cl2O5 (SG:63) by Materials Project

Dataset · Thu Feb 04 00:00:00 EST 2016

DOI:https://doi.org/10.17188/1273516· OSTI ID:1273516

The Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

• Research Organization: Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
• Sponsoring Organization: USDOE Office of Science (SC), Basic Energy Sciences (BES)
• Contributing Organization: MIT; UC Berkeley; Duke; U Louvain
• DOE Contract Number: AC02-05CH11231; EDCBEE
• OSTI ID: 1273516
• Report Number(s): mp-566692
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Cl2 Mo1 O5 Pb3
Cl-Mo-O-Pb
ICSD-156172
electronic bandstructure