{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.7768456 0.4822977 0.5773514 ] [ -2.6960906 -2.980002 2.7152323 ] [ 3.0893958 -4.8473564 6.1171876 ] [ -5.2346872 -3.6512888 0.7216856 ] [ 5.1168147 2.0886287 -4.6755281 ] [ -0.8628902 5.3767408 -4.989719 ] [ 0.2446006 -2.2726403 -3.6724417 ] [ -5.4339888 5.8036203 3.206232 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.255526962291347e-09 7.727260992056122e-10 9.250189150661491e-10 ] [ -4.319613326878644e-09 -4.774489534337241e-09 4.350281711101012e-09 ] [ 4.949757723157713e-09 -7.766321096765252e-09 9.800814957767664e-09 ] [ -8.386893449041014e-09 -5.850009551148887e-09 1.156267795888021e-09 ] [ 8.198040885305765e-09 3.346352072671897e-09 -7.491021811713444e-09 ] [ -1.382502504757436e-09 8.61448840586149e-09 -7.994411126161556e-09 ] [ 3.918933627536525e-10 -3.641171156147898e-09 -5.883900232991007e-09 ] [ -8.706209813049048e-09 9.298424760660284e-09 5.136949951260826e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.738232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841978060472643e-18 } }