{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.813054 0.19358 0.841617 ] [ 0.333261 0.582652 0.826467 ] [ 0.659068 0.410353 0.171806 ] [ 0.62967 0.207153 0.442379 ] [ 0.767116 0.827703 0.186573 ] [ 0.215713 0.836028 0.188921 ] [ 0.217361 0.151499 0.78528 ] [ 0.376975 0.790608 0.555308 ] [ 0.116892 0.278211 0.357068 ] [ 0.8316 0.729441 0.749499 ] [ 0.843141 0.32489 0.133004 ] [ 0.743253 0.047073 0.328362 ] [ 0.438926 0.305798 0.980199 ] [ 0.379809 0.074692 0.325048 ] [ 0.013029 0.895214 0.227686 ] [ 0.63553 0.389486 0.369802 ] [ 0.720618 0.662599 0.26743 ] [ 0.727507 0.331524 0.681572 ] [ 0.29248 0.706814 0.305401 ] [ 0.169573 0.281251 0.656929 ] [ 0.305723 0.584098 0.575914 ] [ 0.042627 0.080839 0.86263 ] [ 0.623017 0.897021 0.659314 ] [ 0.647369 0.738821 0.945278 ] [ 0.252862 0.94143 0.644437 ] [ 0.167628 0.73062 0.952872 ] ] } "species" { "source-value" [ "Li" "Li" "Si" "Si" "Si" "Si" "Si" "Si" "Bi" "Bi" "O" "O" "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" 7.17504125 "source-unit" "angstrom" } "b" { "source-value" 7.48554328 "source-unit" "angstrom" } "c" { "source-value" 7.76817355 "source-unit" "angstrom" } "alpha" { "source-value" 112.93687685 "source-unit" "degree" } "beta" { "source-value" 106.82769641 "source-unit" "degree" } "gamma" { "source-value" 99.5979657 "source-unit" "degree" } }