{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.063764 0 0.677925 ] [ 0.022313 0.5 0.446988 ] [ 0.980033 0 0.211322 ] [ 0.213069 0 0.172717 ] [ 0.25919 0.5 0.40504 ] [ 0.791575 0.5 0.626503 ] [ 0.856892 0 0.892091 ] [ 0.563764 0.5 0.677925 ] [ 0.522313 0 0.446988 ] [ 0.480033 0.5 0.211322 ] [ 0.713069 0.5 0.172717 ] [ 0.75919 0 0.40504 ] [ 0.291575 0 0.626503 ] [ 0.356892 0.5 0.892091 ] [ 0.002246 0.5 0.999167 ] [ 0.934201 0 0.740304 ] [ 0.913733 0.5 0.536338 ] [ 0.370764 0.5 0.321862 ] [ 0.834389 0.5 0.103428 ] [ 0.502246 0 0.999167 ] [ 0.434201 0.5 0.740304 ] [ 0.413733 0 0.536338 ] [ 0.870764 0 0.321862 ] [ 0.334389 0 0.103428 ] [ 0.120933 0.5 0.924014 ] [ 0.620933 0 0.924014 ] ] } "species" { "source-value" [ "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 14.9148150207 "source-unit" "angstrom" } "b" { "source-value" 4.03226846536 "source-unit" "angstrom" } "c" { "source-value" 16.919525112 "source-unit" "angstrom" } "beta" { "source-value" 125.959673747 "source-unit" "degree" } }