{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.999438 0.528554 0.984873 ] [ 0.514883 0.81609 0.842113 ] [ 0.484927 0.53218 0.499636 ] [ 0.515073 0.03218 0.500364 ] [ 0.485117 0.31609 0.157887 ] [ 0.000562 0.028554 0.015127 ] [ 0.080624 0.25379 0.672857 ] [ 0.919376 0.75379 0.327143 ] [ 0.013889 0.750318 0.670095 ] [ 0.986111 0.250318 0.329905 ] [ 0.485817 0.267766 0.863343 ] [ 0.514183 0.767766 0.136657 ] [ 0.696281 0.278286 0.93343 ] [ 0.288457 0.243906 0.928365 ] [ 0.918792 0.85299 0.79996 ] [ 0.045756 0.529485 0.715358 ] [ 0.455577 0.280054 0.718476 ] [ 0.262381 0.82331 0.625982 ] [ 0.811929 0.76867 0.536601 ] [ 0.188071 0.26867 0.463399 ] [ 0.737619 0.32331 0.374018 ] [ 0.544423 0.780054 0.281524 ] [ 0.954244 0.029485 0.284642 ] [ 0.081208 0.35299 0.20004 ] [ 0.711543 0.743906 0.071635 ] [ 0.303719 0.778286 0.06657 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Ge" "Ge" "P" "P" "C" "C" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.48709517 "source-unit" "angstrom" } "b" { "source-value" 6.88353591 "source-unit" "angstrom" } "c" { "source-value" 9.25902658 "source-unit" "angstrom" } "beta" { "source-value" 95.44407129 "source-unit" "degree" } }