{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7981346 -2.7867811 -0.4811343 ] [ 0.1849668 1.4766148 0.8465809 ] [ 1.6150041 -0.7569543 2.2310125 ] [ -1.5247435 2.0570039 -3.4940502 ] [ -1.1198369 -1.4918147 1.6208597 ] [ -0.7571799 3.2173066 -1.34822 ] [ 3.3345021 -1.6882929 2.7390405 ] [ -2.5308473 -0.0270822 -2.1140891 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.278752606906936e-09 -4.464915562492816e-09 -7.708621332759461e-10 ] [ 2.963494850257511e-10 2.365797729978583e-09 1.35637213677069e-09 ] [ 2.587521832834199e-09 -1.212774492465826e-09 3.574476097661924e-09 ] [ -2.442908408543379e-09 3.295683584626873e-09 -5.598085588463027e-09 ] [ -1.794176515070994e-09 -2.390150654597719e-09 2.596903538332249e-09 ] [ -1.213135943514456e-09 5.154693458933984e-09 -2.16008658149148e-09 ] [ 5.342461350643931e-09 -2.704943435728098e-09 4.388426688679677e-09 ] [ -4.054864408281988e-09 -4.339046803731479e-11 -3.387144158214089e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.480003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.684523178084991e-18 } }