{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Icma" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.25 0 ] [ 0.5 0.75 0 ] [ 0 0.25 0.767929 ] [ 0 0.25 0.232071 ] [ 0 0.75 0.232071 ] [ 0 0.75 0.767929 ] [ 0 0.75 0.5 ] [ 0 0.25 0.5 ] [ 0.5 0.75 0.267929 ] [ 0.5 0.75 0.732071 ] [ 0.5 0.25 0.732071 ] [ 0.5 0.25 0.267929 ] [ 0 0.5 0 ] [ 0 0 0 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0.270004 0.5 0.868535 ] [ 0.270004 0 0.131465 ] [ 0.729996 0 0.868535 ] [ 0.729996 0.5 0.131465 ] [ 0.770004 0 0.368535 ] [ 0.770004 0.5 0.631465 ] [ 0.229996 0.5 0.368535 ] [ 0.229996 0 0.631465 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Ag" "Ag" "Ag" "Ag" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.44631602 "source-unit" "angstrom" } "b" { "source-value" 7.01219089 "source-unit" "angstrom" } "c" { "source-value" 12.64434709 "source-unit" "angstrom" } }