{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1854996 0.4736791 1.206297 ] [ 0.6742688 0.1009159 2.297624 ] [ 0.6067687 1.83215 2.754335 ] [ 0.1838578 2.712055 1.507331 ] [ 1.981528 1.354685 0.3328332 ] [ 2.901733 2.736996 1.329123 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.854996e-11 4.736791e-11 1.206297e-10 ] [ 6.742688e-11 1.009159e-11 2.297624e-10 ] [ 6.067687000000001e-11 1.83215e-10 2.754335e-10 ] [ 1.838578e-11 2.712055e-10 1.507331e-10 ] [ 1.981528e-10 1.354685e-10 3.328332e-11 ] [ 2.901733e-10 2.736996e-10 1.329123e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -59.097134 -2.3361886 -111.2380185 ] [ 41.6903508 -87.9038812 108.6848226 ] [ -3.0915214 21.3032574 72.5905834 ] [ -30.861707 65.6545572 -25.1676356 ] [ 33.4718483 -6.8873053 -46.2024313 ] [ 17.8881633 10.1695605 1.3326795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.468404645108477e-08 -3.742986756699483e-09 -1.782229525848179e-07 ] [ 6.679530536471057e-08 -1.408375433362206e-07 1.741322818055155e-07 ] [ -4.953163309782885e-09 3.413158095316459e-08 1.163029356137126e-07 ] [ -4.94459054333797e-08 1.051901965948163e-07 -4.032299735913378e-08 ] [ 5.362781280122422e-08 -1.103467953197193e-08 -7.402445525297815e-08 ] [ 2.865999702831257e-08 1.629343207691116e-08 2.135187937919434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 80.430513 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.288638875275505e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.09131 0.5683038 0.4535775 ] [ 0.6371855 -0.1157075 2.7936959 ] [ 1.1090021 2.3074238 3.1781827 ] [ -0.6172127 2.7566778 1.4287865 ] [ 2.2975397 1.2331159 -0.1748855 ] [ 3.0158313 2.4606672 1.748186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.131e-12 5.683038000000001e-11 4.535775000000001e-11 ] [ 6.371855e-11 -1.157075e-11 2.7936959e-10 ] [ 1.1090021e-10 2.3074238e-10 3.1781827e-10 ] [ -6.172126999999999e-11 2.7566778e-10 1.4287865e-10 ] [ 2.2975397e-10 1.2331159e-10 -1.748855e-11 ] [ 3.0158313e-10 2.4606672e-10 1.748186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.73e-05 3.31e-05 5.34e-05 ] [ -1.42e-05 1.56e-05 7.3e-06 ] [ -4.53e-05 -1.14e-05 -6.09e-05 ] [ 2.62e-05 -3.49e-05 1.46e-05 ] [ -2.09e-05 3.78e-05 -1.4e-06 ] [ 6.9e-06 -4.03e-05 -1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.578295416384e-14 5.303204614848e-14 8.555623155072e-14 ] [ -2.275090801536e-14 2.499395528448e-14 1.169588933184e-14 ] [ -7.257860092224001e-14 -1.826481347712e-14 -9.757255620672e-14 ] [ 4.197702746496e-14 -5.591596406592e-14 2.339177866368e-14 ] [ -3.348549137472e-14 6.056227626623999e-14 -2.24304726912e-15 ] [ 1.105501868352e-14 -6.456771781824e-14 -2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }