{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43079e-10 0.0 0.0 ] "source-value" [ 5.43079 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] "source-value" [ -0.0839771 5.43297 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] "source-value" [ 0.0398452 0.0785902 5.46584 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.968956325506877e-09 2.35175575392959e-09 -6.328023111623781e-09 ] [ -2.209191514728213e-09 5.003586371522054e-10 1.768763736035991e-09 ] [ -8.920816885310669e-10 -1.400648276511631e-09 -3.917336898316236e-09 ] [ -3.592183804878628e-09 -1.850733335003388e-09 8.24467383803077e-09 ] [ 8.437779379605931e-09 3.174232801781947e-09 -4.931656011260589e-09 ] [ -1.187576730323384e-09 -4.488019553449891e-09 1.417926309408e-12 ] [ 3.250303667084544e-10 2.395522572897646e-09 -3.635407646189895e-10 ] [ -3.850732333359972e-09 -6.824686007964788e-10 5.525701125225764e-09 ] ] "source-value" [ [ 1.8530768 1.4678505 -3.9496414 ] [ -1.3788689 0.3122993 1.1039755 ] [ -0.5567936 -0.8742159 -2.4450094 ] [ -2.2420648 -1.1551369 5.1459207 ] [ 5.2664477 1.9812003 -3.0780976 ] [ -0.7412271 -2.8012015 0.000885 ] [ 0.202868 1.4951676 -0.2269043 ] [ -2.4034381 -0.4259634 3.4488714 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.668122770707891e-18 "source-value" -35.37764 } }