{ "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" [ [ 0.051024 0.410643 0.768351 ] [ 0.948976 0.589357 0.231649 ] [ 0 0.5 0 ] [ 0.645479 0.390512 0.226227 ] [ 0.894727 0.680274 0.589812 ] [ 0.257017 0.780738 0.304686 ] [ 0.791557 0.860073 0.130724 ] [ 0.208443 0.139927 0.869276 ] [ 0.354521 0.609488 0.773773 ] [ 0.105273 0.319726 0.410188 ] [ 0.742983 0.219262 0.695314 ] ] } "species" { "source-value" [ "W" "W" "N" "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" 6.70367316544 "source-unit" "angstrom" } "b" { "source-value" 6.75469684966 "source-unit" "angstrom" } "c" { "source-value" 7.05456317472 "source-unit" "angstrom" } "alpha" { "source-value" 89.9533436591 "source-unit" "degree" } "beta" { "source-value" 97.8008552286 "source-unit" "degree" } "gamma" { "source-value" 97.0372344311 "source-unit" "degree" } }