{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcb" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.840819 0.574136 ] [ 0.5 0.159181 0.425864 ] [ 0.5 0.659181 0.074136 ] [ 0.5 0.340819 0.925864 ] [ 0.5 0.562523 0.33105 ] [ 0.5 0.062523 0.16895 ] [ 0.5 0.937477 0.83105 ] [ 0.5 0.437477 0.66895 ] [ 0 0.83391 0.279711 ] [ 0 0.66609 0.779711 ] [ 0 0 0 ] [ 0 0.16609 0.720289 ] [ 0 0.33391 0.220289 ] [ 0 0.5 0.5 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "B" "B" "B" "B" "Rh" "Rh" "Rh" "Rh" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 2.85245596061 "source-unit" "angstrom" } "b" { "source-value" 5.80748304263 "source-unit" "angstrom" } "c" { "source-value" 9.57730436561 "source-unit" "angstrom" } }