{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0253176 -5.1316829 -1.5841795 ] [ 5.0187258 0.4757734 0.5930723 ] [ 5.4197959 -5.0963432 6.7710065 ] [ -22.5052662 18.0474309 -11.8491525 ] [ -4.7173783 -4.8386627 -5.1423638 ] [ 13.2125317 -7.8985197 -6.2820095 ] [ 11.8767556 -4.6299465 24.6936202 ] [ -5.2798468 9.0719507 -7.1999937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.847093129214766e-09 -8.221862367739145e-09 -2.538135358050634e-09 ] [ 8.040885142965776e-09 7.622730182785267e-10 9.502065735040839e-10 ] [ 8.683470280487695e-09 -8.165241926613059e-09 1.084834831358484e-08 ] [ -3.605741135052046e-08 2.89151718534835e-08 -1.898443511179388e-08 ] [ -7.55807322372925e-09 -7.752392253877004e-09 -8.238975056008248e-09 ] [ 2.116880939131888e-08 -1.265482360226823e-08 -1.00648887525435e-08 ] [ 1.902866015327547e-08 -7.417992037854788e-09 3.956354096735462e-08 ] [ -8.459247104365693e-09 1.453486731659019e-08 -1.153566157604729e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.757153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.325662525096858e-18 } }