{ "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" [ [ 2.941384 3.398999 4.495714 ] [ 5.079285 2.89491 3.814281 ] [ 5.144035 3.811985 1.647129 ] [ 3.115427 4.213177 2.153983 ] [ 4.243195 5.045313 3.693161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.941384e-10 3.398999e-10 4.495714000000001e-10 ] [ 5.079285e-10 2.89491e-10 3.814281e-10 ] [ 5.144035e-10 3.811985e-10 1.647129e-10 ] [ 3.115427e-10 4.213177e-10 2.153983e-10 ] [ 4.243195e-10 5.045313e-10 3.693161e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -99.0272833 -52.8560973 -83.1087993 ] [ 54.7510989 -45.4963411 -5.0260371 ] [ 52.8297643 -31.1021975 -24.9967144 ] [ -131.5069197 -76.981064 53.1968546 ] [ 122.9533397 206.4356999 59.9346963 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.586591994317584e-07 -8.46848040584905e-08 -1.331549763182556e-07 ] [ 8.772093134340309e-08 -7.289317464291385e-08 -8.05259920323712e-09 ] [ 8.464261394118737e-08 -4.983121410055321e-08 -4.004915173845132e-08 ] [ -2.106973139526543e-07 -1.233372620012586e-07 8.523075744241542e-08 ] [ 1.969929679396046e-07 3.307464548032161e-07 9.602596997774625e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 57.133383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.153777126397282e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6821717 3.2705476 4.5878332 ] [ 5.4373973 2.4600745 4.0450033 ] [ 5.3687647 3.8601091 1.4802442 ] [ 2.4782349 4.1451572 1.8064183 ] [ 4.5567575 5.6284956 3.884769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6821717e-10 3.2705476e-10 4.5878332e-10 ] [ 5.4373973e-10 2.4600745e-10 4.0450033e-10 ] [ 5.3687647e-10 3.8601091e-10 1.4802442e-10 ] [ 2.4782349e-10 4.1451572e-10 1.8064183e-10 ] [ 4.5567575e-10 5.6284956e-10 3.884769e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-07 -7e-07 -3.2e-06 ] [ 3.9e-06 -3.7e-06 6.3e-06 ] [ -6.6e-06 -4e-07 -3.3e-06 ] [ -3.8e-06 -2.4e-06 -7.8e-06 ] [ 5.6e-06 7.3e-06 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.4419589706e-15 -1.1215236438e-15 -5.1269652288e-15 ] [ 6.248488872599999e-15 -5.9280535458e-15 1.00937127942e-14 ] [ -1.05743657844e-14 -6.408706536e-16 -5.2871828922e-15 ] [ -6.088271209199999e-15 -3.845223921599999e-15 -1.24969777452e-14 ] [ 8.972189150399999e-15 1.16958894282e-14 1.2817413072e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.044174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929689415863031e-18 } }