{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc2_1n" } "basis-atom-coordinates" { "source-value" [ [ 0.795599 0.870065 0.075469 ] [ 0.191991 0.121415 0.162244 ] [ 0.691991 0.621415 0.337756 ] [ 0.295599 0.370065 0.424531 ] [ 0.704401 0.870065 0.575469 ] [ 0.308009 0.121415 0.662244 ] [ 0.808009 0.621415 0.837756 ] [ 0.204401 0.370065 0.924531 ] [ 0.688584 0.116337 0.334073 ] [ 0.811416 0.116337 0.834073 ] [ 0.188584 0.616337 0.165927 ] [ 0.311416 0.616337 0.665927 ] [ 0.69 0.369622 0.088 ] [ 0.19 0.869622 0.412 ] [ 0.81 0.369622 0.588 ] [ 0.31 0.869622 0.912 ] [ 0.197448 0.867523 0.055471 ] [ 0.367332 0.369801 0.089411 ] [ 0.794328 0.584805 0.160866 ] [ 0.797725 0.154601 0.160398 ] [ 0.297725 0.654601 0.339602 ] [ 0.294328 0.084805 0.339134 ] [ 0.867332 0.869801 0.410589 ] [ 0.697448 0.367523 0.444529 ] [ 0.302552 0.867523 0.555471 ] [ 0.132668 0.369801 0.589411 ] [ 0.705672 0.584805 0.660866 ] [ 0.702275 0.154601 0.660398 ] [ 0.202275 0.654601 0.839602 ] [ 0.205672 0.084805 0.839134 ] [ 0.632668 0.869801 0.910589 ] [ 0.802552 0.367523 0.944529 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "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" 5.12597381 "source-unit" "angstrom" } "b" { "source-value" 6.29900538 "source-unit" "angstrom" } "c" { "source-value" 10.77594712 "source-unit" "angstrom" } }