{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_12_12" } "basis-atom-coordinates" { "source-value" [ [ 0.373557 0.846799 0.451554 ] [ 0.626443 0.153201 0.951554 ] [ 0.846799 0.373557 0.548446 ] [ 0.346799 0.126443 0.201554 ] [ 0.653201 0.873557 0.701554 ] [ 0.126443 0.346799 0.798446 ] [ 0.873557 0.653201 0.298446 ] [ 0.153201 0.626443 0.048446 ] [ 0.020447 0.024156 0.374175 ] [ 0.979553 0.975844 0.874175 ] [ 0.024156 0.020447 0.625825 ] [ 0.524156 0.479553 0.124175 ] [ 0.475844 0.520447 0.624175 ] [ 0.479553 0.524156 0.875825 ] [ 0.520447 0.475844 0.375825 ] [ 0.975844 0.979553 0.125825 ] [ 0.807489 0.285952 0.06549 ] [ 0.214048 0.307489 0.31549 ] [ 0.785952 0.692511 0.81549 ] [ 0.307489 0.214048 0.68451 ] [ 0.692511 0.785952 0.18451 ] [ 0.192511 0.714048 0.56549 ] [ 0.285952 0.807489 0.93451 ] [ 0.714048 0.192511 0.43451 ] ] } "species" { "source-value" [ "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.3633493 "source-unit" "angstrom" } "c" { "source-value" 20.01517656 "source-unit" "angstrom" } }