{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmc2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.662759 0 0.486075 ] [ 0.337241 0 0.986075 ] [ 0.162759 0.5 0.486075 ] [ 0.837241 0.5 0.986075 ] [ 0.84662 0.170655 0.011722 ] [ 0.15338 0.829345 0.511722 ] [ 0.15338 0.170655 0.511722 ] [ 0.84662 0.829345 0.011722 ] [ 0.34662 0.670655 0.011722 ] [ 0.65338 0.329345 0.511722 ] [ 0.65338 0.670655 0.511722 ] [ 0.34662 0.329345 0.011722 ] [ 0.773636 0 0.969105 ] [ 0.226364 0 0.469105 ] [ 0.874635 0.780553 0.359188 ] [ 0.874635 0.219447 0.359188 ] [ 0.125365 0.780553 0.859188 ] [ 0.125365 0.219447 0.859188 ] [ 0.273636 0.5 0.969105 ] [ 0.726364 0.5 0.469105 ] [ 0.374635 0.280553 0.359188 ] [ 0.374635 0.719447 0.359188 ] [ 0.625365 0.280553 0.859188 ] [ 0.625365 0.719447 0.859188 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "N" "N" "N" "N" "N" "N" "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" 5.53546162 "source-unit" "angstrom" } "b" { "source-value" 9.52465847 "source-unit" "angstrom" } "c" { "source-value" 4.91306476 "source-unit" "angstrom" } }