{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_12_12_1" } "basis-atom-coordinates" { "source-value" [ [ 0.99884 0.023946 0.016502 ] [ 0.732725 0.755509 0.225325 ] [ 0.267275 0.255509 0.274675 ] [ 0.49884 0.476054 0.983498 ] [ 0.00116 0.523946 0.483498 ] [ 0.767275 0.244491 0.725325 ] [ 0.50116 0.976054 0.516502 ] [ 0.232725 0.744491 0.774675 ] [ 0.671505 0.076035 0.617604 ] [ 0.828495 0.923965 0.117604 ] [ 0.132533 0.874559 0.92282 ] [ 0.079576 0.664957 0.635451 ] [ 0.632533 0.625441 0.07718 ] [ 0.579576 0.835043 0.364549 ] [ 0.613408 0.361052 0.833532 ] [ 0.113408 0.138948 0.166468 ] [ 0.328495 0.576035 0.882396 ] [ 0.867467 0.374559 0.57718 ] [ 0.420424 0.335043 0.135451 ] [ 0.171505 0.423965 0.382396 ] [ 0.386592 0.861052 0.666468 ] [ 0.920424 0.164957 0.864549 ] [ 0.886592 0.638948 0.333532 ] [ 0.367467 0.125441 0.42282 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "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" 7.30285916 "source-unit" "angstrom" } "b" { "source-value" 7.31770961 "source-unit" "angstrom" } "c" { "source-value" 7.32892461 "source-unit" "angstrom" } }