{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm2_1n" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.49223 0.933919 ] [ 0 0.99223 0.066081 ] [ 0 0.997547 0.305804 ] [ 0.5 0.490464 0.436767 ] [ 0 0.990464 0.563233 ] [ 0.5 0.497547 0.694196 ] [ 0 0.748629 0.434348 ] [ 0.5 0.248629 0.565652 ] [ 0.5 0.244064 0.813365 ] [ 0 0.761166 0.933949 ] [ 0.5 0.261166 0.066051 ] [ 0 0.744064 0.186635 ] [ 0.5 0.2659 0.3045 ] [ 0 0.7659 0.6955 ] ] } "species" { "source-value" [ "In" "In" "In" "In" "In" "In" "As" "As" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.24630257 "source-unit" "angstrom" } "b" { "source-value" 6.13005498 "source-unit" "angstrom" } "c" { "source-value" 17.09165257 "source-unit" "angstrom" } }