{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P6_3mc" } "basis-atom-coordinates" { "source-value" [ [ 0.333333 0.666667 0.880492 ] [ 0.666667 0.333333 0.380492 ] [ 0.666667 0.333333 0.115694 ] [ 0.333333 0.666667 0.615694 ] [ 0 0 0.734655 ] [ 0 0 0.234655 ] [ 0 0 0.500185 ] [ 0 0 0.000185 ] [ 0.666667 0.333333 0.752643 ] [ 0.333333 0.666667 0.252643 ] ] } "species" { "source-value" [ "Tm" "Tm" "Tm" "Tm" "Ni" "Ni" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.0866468469 "source-unit" "angstrom" } "c" { "source-value" 13.80678136 "source-unit" "angstrom" } }