{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbn2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.999043 0.994389 0.260175 ] [ 0.000957 0.005611 0.760175 ] [ 0.500957 0.494389 0.260175 ] [ 0.499043 0.505611 0.760175 ] [ 0.511689 0.945091 0.517736 ] [ 0.488311 0.054909 0.017736 ] [ 0.988311 0.445091 0.517736 ] [ 0.011689 0.554909 0.017736 ] [ 0.361932 0.579422 0.507823 ] [ 0.638068 0.420578 0.007823 ] [ 0.138068 0.079422 0.507823 ] [ 0.861932 0.920578 0.007823 ] [ 0.302913 0.795122 0.175401 ] [ 0.697087 0.204878 0.675401 ] [ 0.197087 0.295122 0.175401 ] [ 0.802913 0.704878 0.675401 ] [ 0.834833 0.661051 0.315066 ] [ 0.165167 0.338949 0.815066 ] [ 0.665167 0.161051 0.315066 ] [ 0.334833 0.838949 0.815066 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "La" "La" "La" "La" "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" 5.92694127 "source-unit" "angstrom" } "b" { "source-value" 6.13268314 "source-unit" "angstrom" } "c" { "source-value" 8.46152975 "source-unit" "angstrom" } }