{ "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" [ 5.43856 0 0 ] "si-unit" "m" "si-value" [ 5.43856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00547847 5.34673 0 ] "si-unit" "m" "si-value" [ -5.47847e-13 5.34673e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698619 0.130192 5.52638 ] "si-unit" "m" "si-value" [ -6.986190000000001e-12 1.30192e-11 5.526379999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0176967 -0.0436428 -0.0335652 ] [ 1.35227 1.24207 1.37266 ] [ -0.0530244 2.758 2.7242 ] [ 1.3158 4.14206 3.88387 ] [ 2.73162 0.0656859 2.694 ] [ 4.07939 1.42095 3.99542 ] [ 2.69114 2.74306 -0.00706676 ] [ 4.05369 4.20359 1.27338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.76967e-12 -4.36428e-12 -3.35652e-12 ] [ 1.35227e-10 1.24207e-10 1.37266e-10 ] [ -5.30244e-12 2.758e-10 2.7242e-10 ] [ 1.3158e-10 4.14206e-10 3.88387e-10 ] [ 2.73162e-10 6.568590000000001e-12 2.694e-10 ] [ 4.07939e-10 1.42095e-10 3.99542e-10 ] [ 2.69114e-10 2.74306e-10 -7.06676e-13 ] [ 4.05369e-10 4.20359e-10 1.27338e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.487111 0.7564198 -1.8521758 ] [ -0.6669802 1.832184 -0.6821631 ] [ 0.2347392 -0.1648571 -1.6529942 ] [ -0.318929 -0.2573023 2.4664929 ] [ 0.6243478 0.2346215 0.0123344 ] [ -0.930708 0.4418099 1.648904 ] [ 0.1727242 -0.7142222 -0.9539274 ] [ -0.6023051 -2.1286537 1.0135291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.382614476734509e-09 1.211918119070212e-09 -2.967512764371537e-09 ] [ -1.068620082976508e-09 2.935482369803827e-09 -1.092945770392453e-09 ] [ 3.760936582252954e-10 -2.641301913928877e-10 -2.648388661557999e-09 ] [ -5.109805874951233e-10 -4.122437295380678e-10 3.951757259749192e-09 ] [ 1.000315448407914e-09 3.759050820370272e-10 1.976188731159552e-11 ] [ -1.491158598391526e-09 7.078574926179859e-10 2.641835438743603e-09 ] [ 2.767346750863834e-10 -1.144310110896342e-09 -1.52836017822053e-09 ] [ -9.649991498086061e-10 -3.410479191919417e-09 1.623852628520465e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.128433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.788413069873921e-18 } }