{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Immm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.170781 ] [ 0 0.5 0 ] [ 0 0 0.829219 ] [ 0.5 0.5 0.670781 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0.329219 ] [ 0.5 0.285512 0.117644 ] [ 0.5 0.285512 0.882356 ] [ 0.5 0.714488 0.117644 ] [ 0.5 0.714488 0.882356 ] [ 0 0.785512 0.617644 ] [ 0 0.785512 0.382356 ] [ 0 0.214488 0.617644 ] [ 0 0.214488 0.382356 ] [ 0 0.5 0.818316 ] [ 0 0.844475 0 ] [ 0 0.5 0.181684 ] [ 0 0.155525 0 ] [ 0.5 0 0.318316 ] [ 0.5 0.344475 0.5 ] [ 0.5 0 0.681684 ] [ 0.5 0.655525 0.5 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Pr" "Pr" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.73444173594 "source-unit" "angstrom" } "b" { "source-value" 8.91642817134 "source-unit" "angstrom" } "c" { "source-value" 18.2589602997 "source-unit" "angstrom" } }