{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6694255 -0.9758969 -1.7092228 ] [ -0.1535315 0.8379334 0.1695537 ] [ 1.6740332 1.3260195 -2.3698952 ] [ -1.5174665 -2.9622043 0.2007821 ] [ 1.1342154 -1.1586311 0.4265116 ] [ 0.9796565 2.4715482 3.0976955 ] [ -0.4474815 0.4612311 0.1845752 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.674714506267351e-09 -1.563559197491196e-09 -2.738476809898315e-09 ] [ -2.459845798563552e-10 1.342517303267455e-09 2.71654974110137e-10 ] [ 2.68209685548301e-09 2.124517441624906e-09 -3.796990683186141e-09 ] [ -2.431249349147203e-09 -4.745974475493229e-09 3.216883864951277e-10 ] [ 1.81721339683132e-09 -1.856331660551787e-09 6.833469140200013e-10 ] [ 1.569582740714755e-09 3.959856743220323e-09 4.963055308457366e-09 ] [ -7.169443975405152e-10 7.389736852058669e-10 2.957220702194842e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3407551 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.496553944183837e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3743362 2.5154043 0.8636814 ] [ 2.3273012 4.3468894 2.244789 ] [ 4.6283068 2.2962692 1.2318775 ] [ 5.0033704 0.4948981 2.5129714 ] [ 5.1872725 1.1750358 4.6427025 ] [ 4.9287026 3.4024465 4.7055009 ] [ 4.5812943 4.1269607 2.61237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3743362e-10 2.5154043e-10 8.636814000000001e-11 ] [ 2.3273012e-10 4.346889400000001e-10 2.244789e-10 ] [ 4.6283068e-10 2.2962692e-10 1.2318775e-10 ] [ 5.0033704e-10 4.948981e-11 2.5129714e-10 ] [ 5.1872725e-10 1.1750358e-10 4.642702500000001e-10 ] [ 4.9287026e-10 3.4024465e-10 4.7055009e-10 ] [ 4.5812943e-10 4.1269607e-10 2.61237e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.1e-06 3.5e-06 1.16e-05 ] [ -5.8e-06 7.9e-06 -6.4e-06 ] [ 6.4e-06 2.7e-06 -5e-07 ] [ -1.9e-06 -1.2e-06 3.3e-06 ] [ 1e-06 9e-07 -4.7e-06 ] [ 4.1e-06 -3.8e-06 2.1e-06 ] [ -1.29e-05 -1.01e-05 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.457980724928e-14 5.6076181728e-15 1.858524880128e-14 ] [ -9.292624400640001e-15 1.265719530432e-14 -1.025393037312e-14 ] [ 1.025393037312e-14 4.32587687616e-15 -8.010883104e-16 ] [ -3.04413557952e-15 -1.92261194496e-15 5.28718284864e-15 ] [ 1.6021766208e-15 1.44195895872e-15 -7.53023011776e-15 ] [ 6.568924145279999e-15 -6.08827115904e-15 3.36457090368e-15 ] [ -2.066807840832e-14 -1.618198387008e-14 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.769263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.206079126424647e-18 } }