{ "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" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2812709 -2.8774579 -3.510898 ] [ -3.58228 4.7406237 0.8566344 ] [ -0.5389887 -1.8023778 2.9924732 ] [ 0.726421 0.4514981 -1.5189985 ] [ 0.7366627 6.5095888 0.2296696 ] [ 1.376914 -7.0218749 0.9511192 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.052822280891375e-09 -4.610195774716264e-09 -5.625078693613479e-09 ] [ -5.739445265159425e-09 7.595316460150395e-09 1.372479608253036e-09 ] [ -8.635550940153849e-10 -2.887727573008938e-09 4.794470599410563e-09 ] [ 1.163854743058157e-09 7.233797001556205e-10 -2.433703883730269e-09 ] [ 1.180263755355404e-09 1.042951098638153e-08 3.679712636284877e-10 ] [ 2.206059419652212e-09 -1.125028379896234e-08 1.523860945834e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0493403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.692111599923259e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6613941 0.4305014 1.1023047 ] [ -0.301794 1.3829549 1.4141118 ] [ -1.2924457 3.3329118 1.6729177 ] [ 2.2299546 -0.5819153 -0.773163 ] [ 3.1170345 0.9867154 2.665652 ] [ 4.1319836 2.5706345 3.8069313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6613941e-10 4.305014e-11 1.1023047e-10 ] [ -3.01794e-11 1.3829549e-10 1.4141118e-10 ] [ -1.2924457e-10 3.3329118e-10 1.6729177e-10 ] [ 2.2299546e-10 -5.819153000000001e-11 -7.731630000000001e-11 ] [ 3.1170345e-10 9.867154e-11 2.665652e-10 ] [ 4.1319836e-10 2.5706345e-10 3.8069313e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.3821546 -0.1365578 -0.1605203 ] [ -0.3700493 0.4697312 0.0079777 ] [ 0.011605 -0.3039551 -0.0224438 ] [ -0.0743107 0.0267831 0.2145189 ] [ -0.0112282 -0.0295601 -0.1037915 ] [ 0.0618285 -0.0264413 0.064259 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.122791656511757e-10 -2.187897145478823e-10 -2.571818718238022e-10 ] [ -5.928843370034055e-10 7.525923467003291e-10 1.278168442775616e-11 ] [ 1.8593259684384e-11 -4.86989754992926e-10 -3.595893164191104e-11 ] [ -1.190588662152825e-10 4.291125665254848e-11 3.436971662997331e-10 ] [ -1.798955953366656e-11 -4.736050112851008e-11 -1.662923147377632e-10 ] [ 9.90601771991328e-11 -4.236363268355905e-11 1.029542674759872e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.930332 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.071667562958211e-18 } }