{ "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" [ [ 0.736238 0.852041 0.494314 ] [ 0.616938 0.095499 0.671937 ] [ 0.263762 0.147959 0.505686 ] [ 0.383062 0.904501 0.328063 ] [ 0.791291 0.329061 0.195691 ] [ 0.208709 0.670939 0.804309 ] [ 0.730176 0.369597 0.391162 ] [ 0.859316 0.288697 0.004973 ] [ 0.878781 0.55226 0.717 ] [ 0.665221 0.608582 0.181554 ] [ 0.532184 0.796632 0.887964 ] [ 0.140684 0.711303 0.995027 ] [ 0.079692 0.951558 0.782538 ] [ 0.269824 0.630403 0.608838 ] [ 0.334779 0.391418 0.818446 ] [ 0.920308 0.048442 0.217462 ] [ 0.467816 0.203368 0.112036 ] [ 0.121219 0.44774 0.283 ] ] } "species" { "source-value" [ "Te" "Te" "Te" "Te" "W" "W" "Cl" "Cl" "Cl" "Cl" "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" 6.69974030603 "source-unit" "angstrom" } "b" { "source-value" 7.83180046527 "source-unit" "angstrom" } "c" { "source-value" 11.5473214331 "source-unit" "angstrom" } "alpha" { "source-value" 102.234616898 "source-unit" "degree" } "beta" { "source-value" 103.920693863 "source-unit" "degree" } "gamma" { "source-value" 88.4655246527 "source-unit" "degree" } }