Dataset

Materials_Project



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Name Materials_Project
Extended ID Materials Project_JainOngHautierChenRichardsDacekCholiaGunterSkinnerCederPersson__DS_pv1f3dlo5dsc_0
Description Configurations from the Materials Project database: an online resource with the goal of computing properties of all inorganic materials.
Authors Anubhav Jain
Shyue Ping Ong
Geoffroy Hautier
Wei Chen
William Davidson Richards
Stephen Dacek
Shreyas Cholia
Dan Gunter
David Skinner
Gerbrand Ceder
Kristin A. Persson
Elements Co (1.28%)
Li (2.83%)
Mn (1.54%)
O (41.99%)
Er (0.17%)
Ge (0.57%)
Na (2.07%)
Cs (0.35%)
W (0.36%)
Fe (1.6%)
N (1.91%)
C (1.54%)
Mo (0.61%)
Si (2.3%)
F (3.7%)
V (1.17%)
P (3.2%)
Pb (0.27%)
Al (1.02%)
Te (0.65%)
Cr (0.62%)
Sc (0.19%)
H (4.56%)
Ti (0.65%)
Ag (0.34%)
La (0.5%)
Mg (1.7%)
Au (0.17%)
Cu (0.71%)
Zr (0.29%)
Ca (0.71%)
Ta (0.33%)
Rb (0.43%)
S (3.14%)
Cl (1.6%)
Re (0.15%)
U (0.19%)
Ba (0.6%)
Nb (0.49%)
Y (0.32%)
Sr (0.57%)
Cd (0.25%)
Br (0.65%)
Se (1.21%)
In (0.29%)
Sm (0.18%)
Bi (0.43%)
Ni (0.83%)
K (0.85%)
Zn (0.67%)
I (0.68%)
Hg (0.2%)
Sn (0.49%)
B (1.04%)
Ce (0.2%)
Th (0.06%)
Eu (0.11%)
Pt (0.17%)
Ga (0.49%)
Pd (0.21%)
Pr (0.2%)
Sb (0.55%)
Gd (0.09%)
Nd (0.24%)
Ir (0.12%)
Tl (0.24%)
As (0.49%)
Ru (0.14%)
Yb (0.17%)
Rh (0.16%)
Lu (0.11%)
Hf (0.18%)
Dy (0.15%)
Tm (0.11%)
Pu (0.03%)
Tb (0.15%)
Tc (0.03%)
Be (0.12%)
Np (0.02%)
Ho (0.15%)
Pm (0.01%)
Os (0.06%)
Ac (0.0%)
Pa (0.01%)
Xe (0.02%)
Kr (0.0%)
He (0.0%)
Ar (0.0%)
Ne (0.0%)
Number of Data Objects 6,125,917
Number of Configurations 6,342,530
Number of Atoms 200,016,161
Links https://doi.org/10.1063/1.4812323
https://materialsproject.org
Configuration Sets by Name (None)
Configuration Sets by ID (None)
Data Objects Too many to display
ColabFit ID DS_pv1f3dlo5dsc_0
Files colabfitspec.json

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