{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.255753 0.75 0.086624 ] [ 0.768732 0.982681 0.263633 ] [ 0.768732 0.517319 0.263633 ] [ 0.231268 0.482681 0.736367 ] [ 0.231268 0.017319 0.736367 ] [ 0.744247 0.25 0.913376 ] [ 0.225194 0.25 0.353504 ] [ 0.774806 0.75 0.646496 ] [ 0.287363 0.75 0.410294 ] [ 0.712637 0.25 0.589706 ] [ 0.270908 0.25 0.042331 ] [ 0.729092 0.75 0.957669 ] [ 0.02098 0.25 0.082339 ] [ 0.666265 0.75 0.105704 ] [ 0.466406 0.25 0.150442 ] [ 0.183672 0.937764 0.310541 ] [ 0.183672 0.562236 0.310541 ] [ 0.605449 0.75 0.422723 ] [ 0.813624 0.25 0.418422 ] [ 0.186376 0.75 0.581578 ] [ 0.394551 0.25 0.577277 ] [ 0.816328 0.437764 0.689459 ] [ 0.816328 0.062236 0.689459 ] [ 0.533594 0.75 0.849558 ] [ 0.333735 0.25 0.894296 ] [ 0.97902 0.75 0.917661 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Zn" "Zn" "P" "P" "C" "C" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.93091814 "source-unit" "angstrom" } "b" { "source-value" 6.45146261 "source-unit" "angstrom" } "c" { "source-value" 8.47407743 "source-unit" "angstrom" } "beta" { "source-value" 92.35341037 "source-unit" "degree" } }