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Title: Materials Data on H8W3Se(NO6)2 (SG:173) by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1279363· OSTI ID:1279363

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:
1279363
Report Number(s):
mp-633143
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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Related Subjects

36 MATERIALS SCIENCE
crystal structure
H8 N2 O12 Se1 W3
H-N-O-Se-W
ICSD-80391
electronic bandstructure