{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4810057 7.6883567 -2.2357045 ] [ -3.4558654 3.3698255 -9.4014013 ] [ -2.3706833 2.1465917 3.9237543 ] [ -0.7428317 1.0461045 -5.1327996 ] [ 10.8937681 -12.0163685 4.6219777 ] [ 3.2772343 -3.8389622 -2.5311112 ] [ -0.6900522 -1.5320729 4.8320555 ] [ -6.4305642 3.1365252 5.9232292 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.706560933608136e-10 1.231810545859735e-08 -3.581993510428653e-09 ] [ -5.536906794129064e-09 5.399055676757367e-09 -1.506270548971722e-08 ] [ -3.798253389874011e-09 3.439219064478338e-09 6.286547457017026e-09 ] [ -1.190147592734498e-09 1.676044186622253e-09 -8.223651586124546e-09 ] [ 1.745374070603458e-08 -1.925234483623363e-08 7.405224673809062e-09 ] [ 5.250708219603346e-09 -6.150695535649234e-09 -4.0552872226957e-09 ] [ -1.105585511080295e-09 -2.454651401964618e-09 7.741806416291187e-09 ] [ -1.03028997046769e-08 5.025267387392176e-09 9.490059422066512e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.933327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.795847709728131e-18 } }