{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.440774 -2.8225887 -6.9708452 ] [ -4.5899088 2.8781837 -1.3101376 ] [ 0.3666873 -1.6238515 7.0073158 ] [ -3.0492555 3.8914343 -2.3459921 ] [ 0.9632455 1.9777903 0.5174494 ] [ 3.7358151 -0.1319711 1.1014515 ] [ 1.1326423 -4.1689969 2.0007583 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.308374437674716e-09 -4.522285662532435e-09 -1.116852529867105e-08 ] [ -7.353844631550979e-09 4.611358672499665e-09 -2.099071850044838e-09 ] [ 5.874978240445482e-10 -2.601696930385851e-09 1.122695764181902e-08 ] [ -4.885445913195987e-09 6.234765108206146e-09 -3.758693726168591e-09 ] [ 1.543289432905647e-09 3.16876940561185e-09 8.290453379573194e-10 ] [ 5.985435662164373e-09 -2.114410127832774e-10 1.764719856784251e-09 ] [ 1.814693027740018e-09 -6.679469420398434e-09 3.205568198541562e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.061227064916391 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.413074608277744e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6283972 1.8299271 1.1785442 ] [ 0.5513758 2.9786374 2.1447622 ] [ 1.5085774 1.276384 3.4979315 ] [ 2.6441397 4.2681029 2.1177569 ] [ 4.3626971 1.4052392 3.1155246 ] [ 4.7761431 3.169395 1.5787071 ] [ 2.9781696 3.1269834 4.2259276 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6283972e-10 1.8299271e-10 1.1785442e-10 ] [ 5.513758e-11 2.9786374e-10 2.1447622e-10 ] [ 1.5085774e-10 1.276384e-10 3.4979315e-10 ] [ 2.6441397e-10 4.2681029e-10 2.1177569e-10 ] [ 4.3626971e-10 1.4052392e-10 3.1155246e-10 ] [ 4.776143099999999e-10 3.169395e-10 1.5787071e-10 ] [ 2.9781696e-10 3.1269834e-10 4.2259276e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.46e-05 4.09e-05 2.23e-05 ] [ 4e-07 -1.85e-05 -1.04e-05 ] [ 2.64e-05 1.4e-06 1.2e-05 ] [ 2.29e-05 -1.89e-05 1.41e-05 ] [ -2.82e-05 1.31e-05 -2.35e-05 ] [ -9.1e-06 -2.58e-05 -1.11e-05 ] [ -2.7e-05 7.8e-06 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.33917788564e-14 6.552902433059999e-14 3.572853893819999e-14 ] [ 6.408706536e-16 -2.9640267729e-14 -1.66626369936e-14 ] [ 4.22974631376e-14 2.2430472876e-15 1.9226119608e-14 ] [ 3.66898449186e-14 -3.02811383826e-14 2.25906905394e-14 ] [ -4.51813810788e-14 2.09885139054e-14 -3.765115089899999e-14 ] [ -1.45798073694e-14 -4.133615715719999e-14 -1.77841606374e-14 ] [ -4.325876911799999e-14 1.24969777452e-14 -5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.180097064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.912772672126102e-18 } }