{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6773109 1.4690946 9.9783579 ] [ -1.5182408 3.7989518 -7.3288688 ] [ -0.9858255 -0.9746593 4.1522 ] [ -6.4178347 3.0635544 -12.4939397 ] [ 0.8990594 -4.1832832 5.08966 ] [ -1.2335736 1.3426289 -7.0324956 ] [ 4.1369424 -8.7008613 7.7126773 ] [ 4.4421619 4.1845739 -0.077591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.085171688993007e-09 2.353749021863528e-09 1.598709174135498e-08 ] [ -2.432489914504689e-09 6.086591757506078e-09 -1.174214224827055e-08 ] [ -1.57946656828847e-09 -1.561576343705293e-09 6.652557764885759e-09 ] [ -1.028250471249898e-08 4.908355236228972e-09 -2.001749808902497e-08 ] [ 1.440451951390476e-09 -6.702358541225411e-09 8.154534259820929e-09 ] [ -1.976402781956091e-09 2.151128633990421e-09 -1.126730003619887e-08 ] [ 6.628112394876242e-09 -1.39403165556835e-08 1.235707125383487e-08 ] [ 7.117127941988508e-09 6.704426470589877e-09 -1.243144861844928e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.495622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.245066612195414e-18 } }