{ "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" [ [ 0.7859888 0.7922848 0.3283142 ] [ 1.326446 2.971813 1.139898 ] [ 0.4302915 2.603801 2.617302 ] [ 2.920361 1.53739 0.8701039 ] [ 1.870212 1.959004 2.746341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.859888e-11 7.922848000000001e-11 3.283142e-11 ] [ 1.326446e-10 2.971813e-10 1.139898e-10 ] [ 4.302915e-11 2.603801e-10 2.617302e-10 ] [ 2.920361000000001e-10 1.53739e-10 8.701039000000001e-11 ] [ 1.870212e-10 1.959004e-10 2.746341e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1659161 0.0981916 -0.0476101 ] [ 4.2587854 8.6778515 -19.6986839 ] [ -39.4641785 10.716761 10.3847311 ] [ 2.4917423 -1.650773 -1.7453665 ] [ 32.8795669 -17.8420311 11.1069295 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.658268986244074e-10 1.573202871750744e-10 -7.62797897624034e-11 ] [ 6.823326457100342e-09 1.390345090662185e-08 -3.156077106513199e-08 ] [ -6.322858467270517e-08 1.717014406636247e-08 1.663817351879311e-08 ] [ 3.992211291009418e-09 -2.644829928638082e-09 -2.796385424066361e-09 ] [ 5.267887382321981e-08 -2.858608533152131e-08 1.77952629203853e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.8003546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.282309439034416e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5262579 1.1128887 0.369796 ] [ 1.5329167 3.1976692 0.976584 ] [ 0.028868 2.1168753 2.4923462 ] [ 2.8713198 1.2164445 0.8703379 ] [ 2.3739368 2.2204152 2.9928951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.262579e-11 1.1128887e-10 3.69796e-11 ] [ 1.5329167e-10 3.1976692e-10 9.765840000000001e-11 ] [ 2.8868e-12 2.1168753e-10 2.4923462e-10 ] [ 2.871319800000001e-10 1.2164445e-10 8.703379e-11 ] [ 2.3739368e-10 2.2204152e-10 2.9928951e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.65e-05 7e-06 -5.1e-06 ] [ 1.46e-05 -3.1e-06 -1.49e-05 ] [ 1.18e-05 -1.62e-05 8e-06 ] [ 2e-07 6.8e-06 8.7e-06 ] [ -1.01e-05 5.5e-06 3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.6435914461e-14 1.1215236438e-14 -8.1711008334e-15 ] [ 2.33917788564e-14 -4.9667475654e-15 -2.38724318466e-14 ] [ 1.89056842812e-14 -2.59552614708e-14 1.2817413072e-14 ] [ 3.204353268e-16 1.08948011112e-14 1.39389367158e-14 ] [ -1.61819840034e-14 8.811971486999999e-15 5.2871828922e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }