{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2911409 -5.0098829 -0.9688645 ] [ 0.3896278 0.0220086 -1.3185975 ] [ 9.6856324 -12.7941974 -0.4622141 ] [ -6.9544206 11.3375384 -7.7249019 ] [ 2.1703013 6.4445333 10.4745781 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.477342247338672e-09 -8.026717255325704e-09 -1.552292050623082e-09 ] [ 6.242525519737383e-10 3.526166437653888e-11 -2.112626086745328e-09 ] [ 1.551809378894299e-08 -2.049856395618014e-08 -7.405486248241133e-10 ] [ -1.114221009652991e-08 1.816473896190224e-08 -1.23766572221535e-08 ] [ 3.477206002951848e-09 1.032528058522707e-08 1.678212414456369e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7585755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.419725172811671e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0867575 1.1750466 0.234229 ] [ 0.9119665 -0.4229714 1.7496835 ] [ 2.7888021 0.4981266 2.8268612 ] [ 1.4533192 3.0839436 0.375134 ] [ 3.1232613 2.6655975 1.9774811 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.67575e-12 1.1750466e-10 2.34229e-11 ] [ 9.119665000000001e-11 -4.229714e-11 1.7496835e-10 ] [ 2.7888021e-10 4.981266e-11 2.8268612e-10 ] [ 1.4533192e-10 3.0839436e-10 3.751340000000001e-11 ] [ 3.1232613e-10 2.6655975e-10 1.9774811e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.6e-06 5e-07 7.5e-06 ] [ 1.5e-05 -1.88e-05 6.1e-06 ] [ -1.33e-05 1.6e-06 1.9e-06 ] [ 1.8e-06 2.87e-05 -1.74e-05 ] [ 2.2e-06 -1.2e-05 1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.972189076479999e-15 8.010883104e-16 1.2016324656e-14 ] [ 2.4032649312e-14 -3.012092047104e-14 9.77327738688e-15 ] [ -2.130894905664e-14 2.56348259328e-15 3.04413557952e-15 ] [ 2.88391791744e-15 4.598246901696e-14 -2.787787320192e-14 ] [ 3.52478856576e-15 -1.92261194496e-14 3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }