skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on ErGePd by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1744840· OSTI ID:1744840

ErPdGe crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are four inequivalent Er sites. In the first Er site, Er is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. All Er–Pd bond lengths are 3.11 Å. There are four shorter (3.07 Å) and two longer (3.21 Å) Er–Ge bond lengths. In the second Er site, Er is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are a spread of Er–Pd bond distances ranging from 2.95–3.19 Å. There are a spread of Er–Ge bond distances ranging from 3.02–3.28 Å. In the third Er site, Er is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are two shorter (3.19 Å) and four longer (3.24 Å) Er–Pd bond lengths. There are two shorter (2.98 Å) and four longer (3.01 Å) Er–Ge bond lengths. In the fourth Er site, Er is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are a spread of Er–Pd bond distances ranging from 3.04–3.14 Å. There are a spread of Er–Ge bond distances ranging from 3.07–3.21 Å. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a 10-coordinate geometry to six Er and four Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.57–2.74 Å. In the second Pd site, Pd is bonded in a 10-coordinate geometry to six Er and four Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.55–2.92 Å. In the third Pd site, Pd is bonded in a 10-coordinate geometry to six Er, one Pd, and three Ge atoms. The Pd–Pd bond length is 2.99 Å. There are two shorter (2.54 Å) and one longer (2.57 Å) Pd–Ge bond lengths. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Er, three Pd, and one Ge atom. The Ge–Ge bond length is 2.74 Å. In the second Ge site, Ge is bonded in a 10-coordinate geometry to six Er and four Pd atoms. In the third Ge site, Ge is bonded in a 10-coordinate geometry to six Er and four Pd atoms.

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:
1744840
Report Number(s):
mp-1106394
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on Mg17Al11Pd by Materials Project
Dataset · Thu Apr 30 00:00:00 EDT 2020 · OSTI ID:1744840

Materials Data on Sm10Pd21 by Materials Project
Dataset · Wed Apr 29 00:00:00 EDT 2020 · OSTI ID:1744840

Materials Data on Yb12Ga19Au25 by Materials Project
Dataset · Sat May 02 00:00:00 EDT 2020 · OSTI ID:1744840