{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.9300111 -1.8038266 -2.561788 ] [ -3.0849701 9.2336787 -0.3328982 ] [ 22.5479915 -11.1676246 4.1853904 ] [ 1.5825339 2.0961019 -0.9066794 ] [ -0.1155442 1.6416707 -0.3840248 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.35335744575045e-08 -2.890048806497153e-09 -4.10443684104599e-09 ] [ -4.942666970087039e-09 1.479398413711894e-08 -5.333617131464026e-10 ] [ 3.612586482729712e-08 -1.789250704399095e-08 6.70573464780076e-09 ] [ 2.535498816203445e-09 3.358325458994459e-09 -1.452660537240972e-09 ] [ -1.851222159090394e-10 2.630246414592371e-09 -6.15275556367396e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6454543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.44283827245483e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4461607 0.3001753 1.6227797 ] [ 0.3962106 2.5907655 1.5457566 ] [ 2.6064101 -0.2243399 1.9867509 ] [ 2.2619809 3.2050342 0.1855814 ] [ 2.45245 3.2884158 2.5425841 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.461607e-11 3.001753e-11 1.6227797e-10 ] [ 3.962106000000001e-11 2.5907655e-10 1.5457566e-10 ] [ 2.6064101e-10 -2.243399e-11 1.9867509e-10 ] [ 2.2619809e-10 3.2050342e-10 1.855814e-11 ] [ 2.45245e-10 3.2884158e-10 2.5425841e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.04e-05 4.63e-05 -1.28e-05 ] [ 3.6e-05 1.7e-05 1e-07 ] [ 4.87e-05 -5.05e-05 9.4e-06 ] [ -2.76e-05 -1.44e-05 3.2e-05 ] [ -3.67e-05 1.7e-06 -2.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.268440306432e-14 7.418077754303999e-14 -2.050786074624e-14 ] [ 5.76783583488e-14 2.72370025536e-14 1.6021766208e-16 ] [ 7.802600143296e-14 -8.090991935040001e-14 1.506046023552e-14 ] [ -4.422007473408001e-14 -2.307134333952e-14 5.12696518656e-14 ] [ -5.879988198335999e-14 2.72370025536e-15 -4.582225135488e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.152019 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.94696807373174e-18 } }