{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.675782 0.331469 0.098859 ] [ 0.99335 0.9974 0.005255 ] [ 0.998613 0.991525 0.515291 ] [ 0.330124 0.67344 0.593245 ] [ 0.79952 0.642518 0.772984 ] [ 0.659503 0.812567 0.279722 ] [ 0.172718 0.827144 0.28489 ] [ 0.840011 0.180482 0.780693 ] [ 0.341966 0.167187 0.785049 ] [ 0.163674 0.337486 0.288324 ] [ 0.656654 0.30694 0.506298 ] [ 0.321143 0.662934 0.991828 ] [ 0.829278 0.142954 0.40385 ] [ 0.526638 0.042988 0.643252 ] [ 0.687584 0.34872 0.892105 ] [ 0.984339 0.981711 0.696897 ] [ 0.998844 0.005339 0.190061 ] [ 0.316598 0.15051 0.405658 ] [ 0.97257 0.49109 0.66737 ] [ 0.52763 0.517239 0.666226 ] [ 0.160509 0.328092 0.903756 ] [ 0.873351 0.716323 0.388192 ] [ 0.510936 0.524084 0.186606 ] [ 0.028848 0.519118 0.176985 ] [ 0.337347 0.669474 0.391315 ] [ 0.663748 0.834067 0.893138 ] [ 0.480964 0.977602 0.184264 ] [ 0.148057 0.8196 0.900045 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "V" "V" "V" "Fe" "Fe" "Fe" "Te" "Te" "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" 5.94584278 "source-unit" "angstrom" } "b" { "source-value" 6.02220968 "source-unit" "angstrom" } "c" { "source-value" 10.2317785 "source-unit" "angstrom" } "alpha" { "source-value" 90.51310233 "source-unit" "degree" } "beta" { "source-value" 89.83172001 "source-unit" "degree" } "gamma" { "source-value" 118.88339586 "source-unit" "degree" } }