{ "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" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8148368 -15.8552812 6.6840909 ] [ 0.5491171 5.8507965 8.8936298 ] [ 4.6818865 3.4218049 -6.4970078 ] [ 1.0030802 -4.6481207 -2.2791374 ] [ 1.4469787 5.8126071 -3.5338078 ] [ -18.1813327 7.8171765 -8.8514949 ] [ 8.9727421 2.0595978 4.7660157 ] [ -1.2873087 -4.4585809 0.8177115 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.509865749483331e-09 -2.540296106413948e-08 1.070909425951203e-08 ] [ 8.797825869498413e-10 9.374009442588982e-09 1.424916585700609e-08 ] [ 7.50120915334004e-09 5.482335856886706e-09 -1.040935408807575e-08 ] [ 1.607111658468047e-09 -7.447110377551723e-09 -3.651580687955511e-09 ] [ 2.318315463035696e-09 9.3128232782425e-09 -5.661784286206944e-09 ] [ -2.912970642692013e-08 1.25244975321539e-08 -1.418165830475017e-08 ] [ 1.437591773552809e-08 3.299839470597805e-09 7.635998991817153e-09 ] [ -2.062495919884915e-09 -7.14343413877869e-09 1.310118258653091e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.52424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.249651756260815e-18 } }