{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2" } "basis-atom-coordinates" { "source-value" [ [ 0 0.003748 0 ] [ 0.758099 0.914128 0.313084 ] [ 0.241901 0.914128 0.686916 ] [ 0.746466 0.09301 0.678853 ] [ 0.5 0.09653 0 ] [ 0.253534 0.09301 0.321147 ] [ 0.813294 0.011643 0.50733 ] [ 0.186706 0.011643 0.49267 ] [ 0.760564 0.492557 0.319945 ] [ 0.239436 0.492557 0.680055 ] [ 0.750412 0.515548 0.684306 ] [ 0.249588 0.515548 0.315694 ] [ 0 0.503573 0 ] [ 0.5 0.520062 0 ] [ 0.284793 0.020248 0.119466 ] [ 0.715207 0.020248 0.880534 ] [ 0.285789 0.000621 0.878353 ] [ 0.500579 0.016554 0.655111 ] [ 0.006201 0.002688 0.242668 ] [ 0.993799 0.002688 0.757332 ] [ 0.499421 0.016554 0.344889 ] [ 0.714211 0.000621 0.121647 ] ] } "species" { "source-value" [ "U" "Mo" "Mo" "Mo" "Mo" "Mo" "O" "O" "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" 7.35954714727 "source-unit" "angstrom" } "b" { "source-value" 4.12360813 "source-unit" "angstrom" } "c" { "source-value" 10.0638913413 "source-unit" "angstrom" } "beta" { "source-value" 91.4530600488 "source-unit" "degree" } }