{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.103368 0.896632 0.396632 ] [ 0.396632 0.103368 0.896632 ] [ 0.896632 0.396632 0.103368 ] [ 0.603368 0.603368 0.603368 ] [ 0.567246 0.067246 0.432754 ] [ 0.067246 0.432754 0.567246 ] [ 0.432754 0.567246 0.067246 ] [ 0.932754 0.932754 0.932754 ] [ 0.26451 0.26451 0.26451 ] [ 0.73549 0.76451 0.23549 ] [ 0.76451 0.23549 0.73549 ] [ 0.23549 0.73549 0.76451 ] [ 0.371645 0.880943 0.373078 ] [ 0.871645 0.619057 0.626922 ] [ 0.628355 0.380943 0.126922 ] [ 0.128355 0.119057 0.873078 ] [ 0.380943 0.126922 0.628355 ] [ 0.880943 0.373078 0.371645 ] [ 0.619057 0.626922 0.871645 ] [ 0.873078 0.128355 0.119057 ] [ 0.626922 0.871645 0.619057 ] [ 0.126922 0.628355 0.380943 ] [ 0.373078 0.371645 0.880943 ] [ 0.119057 0.873078 0.128355 ] ] } "species" { "source-value" [ "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Cl" "Cl" "Cl" "Cl" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.99259745 "source-unit" "angstrom" } }