{ "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" [ [ 0.141591 0.212749 0.760078 ] [ 0.858409 0.787251 0.239922 ] [ 0.320301 0.270933 0.991762 ] [ 0.679699 0.729067 0.008238 ] [ 0.829517 0.141712 0.838675 ] [ 0.832578 0.079032 0.32918 ] [ 0.361086 0.253551 0.563547 ] [ 0.018914 0.469489 0.727098 ] [ 0.981086 0.530511 0.272902 ] [ 0.638914 0.746449 0.436453 ] [ 0.167422 0.920968 0.67082 ] [ 0.170483 0.858288 0.161325 ] ] } "species" { "source-value" [ "W" "W" "S" "S" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.70865989 "source-unit" "angstrom" } "b" { "source-value" 7.94664131 "source-unit" "angstrom" } "c" { "source-value" 8.07220072 "source-unit" "angstrom" } "alpha" { "source-value" 101.24272675 "source-unit" "degree" } "beta" { "source-value" 94.13640244 "source-unit" "degree" } "gamma" { "source-value" 93.26261198 "source-unit" "degree" } }