{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.218458 0.828106 0.799048 ] [ 0.781542 0.171894 0.200952 ] [ 0.446122 0.26343 0.575357 ] [ 0.553878 0.73657 0.424643 ] [ 0.399084 0.693414 0.274888 ] [ 0.313881 0.534288 0.207757 ] [ 0.672297 0.189753 0.802634 ] [ 0.600916 0.306586 0.725112 ] [ 0.327703 0.810247 0.197366 ] [ 0.686119 0.465712 0.792243 ] [ 0.316784 0.228059 0.450061 ] [ 0.247408 0.399742 0.15691 ] [ 0.683216 0.771941 0.549939 ] [ 0.27073 0.911466 0.135824 ] [ 0.752592 0.600258 0.84309 ] [ 0.72927 0.088534 0.864176 ] ] } "species" { "source-value" [ "K" "K" "C" "C" "C" "C" "C" "C" "C" "C" "N" "N" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.99677911302 "source-unit" "angstrom" } "b" { "source-value" 8.76989286613 "source-unit" "angstrom" } "c" { "source-value" 9.14067769169 "source-unit" "angstrom" } "alpha" { "source-value" 105.164797177 "source-unit" "degree" } "beta" { "source-value" 95.580265537 "source-unit" "degree" } "gamma" { "source-value" 88.7991374596 "source-unit" "degree" } }