{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0652651 -1.7145054 -4.3021244 ] [ -0.8766527 -3.8716585 2.9190261 ] [ -6.1069588 3.8441475 -0.2782123 ] [ 0.3606019 2.8332348 -0.9616244 ] [ 6.5577445 -1.0912185 2.622935 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.045662173741741e-10 -2.746940468115352e-09 -6.892763133453229e-09 ] [ -1.404552460501196e-09 -6.203080732421597e-09 4.676795372925003e-09 ] [ -9.784426613548823e-09 6.159003251406769e-09 -4.457452426789959e-10 ] [ 5.777479335960595e-10 4.539342557796964e-09 -1.540692131670827e-09 ] [ 1.050666492307979e-08 -1.748324768884445e-09 4.202405134878048e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0627552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.111428018273629e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5582836 2.1075112 1.4472765 ] [ 2.2269542 1.4484539 2.7924007 ] [ 0.6370157 4.342945 1.2897535 ] [ 2.3540866 5.0654946 2.5378593 ] [ 3.3367164 3.2766012 3.466555 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.582836e-11 2.1075112e-10 1.4472765e-10 ] [ 2.2269542e-10 1.4484539e-10 2.7924007e-10 ] [ 6.370157e-11 4.342945e-10 1.2897535e-10 ] [ 2.3540866e-10 5.0654946e-10 2.5378593e-10 ] [ 3.3367164e-10 3.2766012e-10 3.466555e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 -1.7e-06 -8.8e-06 ] [ -3.6e-06 2e-07 9.5e-06 ] [ -6e-06 4.4e-06 6.5e-06 ] [ 1e-07 1e-06 -4e-06 ] [ 2e-06 -3.9e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324656e-14 -2.72370025536e-15 -1.409915426304e-14 ] [ -5.76783583488e-15 3.2043532416e-16 1.52206778976e-14 ] [ -9.6130597248e-15 7.04957713152e-15 1.04141480352e-14 ] [ 1.6021766208e-16 1.6021766208e-15 -6.4087064832e-15 ] [ 3.2043532416e-15 -6.24848882112e-15 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }