{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.529227 0.75 0.050417 ] [ 0.470773 0.25 0.949583 ] [ 0.964778 0.554974 0.697992 ] [ 0.964778 0.945026 0.697992 ] [ 0.567171 0.25 0.425616 ] [ 0.432829 0.75 0.574384 ] [ 0.035222 0.054974 0.302008 ] [ 0.035222 0.445026 0.302008 ] [ 0.888564 0.568649 0.146525 ] [ 0.888564 0.931351 0.146525 ] [ 0.879558 0.25 0.216873 ] [ 0.822229 0.411936 0.49249 ] [ 0.822229 0.088064 0.49249 ] [ 0.584446 0.75 0.401764 ] [ 0.642098 0.601797 0.739531 ] [ 0.642098 0.898203 0.739531 ] [ 0.357902 0.101797 0.260469 ] [ 0.357902 0.398203 0.260469 ] [ 0.415554 0.25 0.598236 ] [ 0.177771 0.588064 0.50751 ] [ 0.177771 0.911936 0.50751 ] [ 0.120442 0.75 0.783127 ] [ 0.111436 0.068649 0.853475 ] [ 0.111436 0.431351 0.853475 ] ] } "species" { "source-value" [ "Na" "Na" "V" "V" "V" "V" "V" "V" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.12260376 "source-unit" "angstrom" } "b" { "source-value" 8.54792349 "source-unit" "angstrom" } "c" { "source-value" 7.44279814 "source-unit" "angstrom" } "beta" { "source-value" 101.9933466 "source-unit" "degree" } }