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Title: Materials Data on KNb(CuSe2)2 (SG:40) by 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
Authors:
Publication Date:
OSTI Identifier:
1281383
Report Number(s):
mp-6599
DOE Contract Number:
AC02-05CH11231; EDCBEE
Resource Type:
Dataset
Data Type:
Specialized Mix
Resource Relation:
Related Information: https://materialsproject.org/citing
Research Org:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Orgs:
MIT; UC Berkeley; Duke; U Louvain
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE crystal structure; Cu2 K1 Nb1 Se4; Cu-K-Nb-Se; ICSD-655976; ICSD-71302; electronic bandstructure