{ "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" [ [ 0.6055026 6.9090918 -1.5465745 ] [ -4.1538045 3.6884018 -10.5591052 ] [ -2.4743003 2.1417645 4.6694451 ] [ -1.3996032 1.3252272 -5.7146694 ] [ 10.4193613 -10.7593022 7.1891757 ] [ 2.4793087 -2.7521364 -3.5815143 ] [ -0.1108576 -2.0817946 5.0185984 ] [ -5.365607 1.5287478 4.5246441 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.70122109553614e-10 1.106958535292099e-08 -2.477885506225449e-09 ] [ -6.655128457273834e-09 5.909471132076637e-09 -1.691755148800771e-08 ] [ -3.964266093498426e-09 3.431485009159401e-09 7.481275771329117e-09 ] [ -2.242411525436867e-09 2.123248037088246e-09 -9.155909708281164e-09 ] [ 1.66936570785283e-08 -1.723830244096201e-08 1.151832922936347e-08 ] [ 3.972290434886041e-09 -4.409408597332677e-09 -5.738218478520877e-09 ] [ -1.776134549579981e-10 -3.335402637427687e-09 8.040681025664288e-09 ] [ -8.596650091800825e-09 2.449323984259435e-09 7.249278994460657e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.448535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.718175429381053e-18 } }