{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.142228 -0.5377793 -0.4866698 ] [ -2.6657151 0.1693247 8.9456108 ] [ -3.6155477 1.8085082 -3.0639809 ] [ -1.121617 -8.5808595 -3.162676 ] [ 2.3829102 -0.2399516 -5.5118847 ] [ -2.1514729 5.6812013 0.3290652 ] [ 9.3136705 1.6995561 2.9505354 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.432227618023142e-09 -8.616174216101893e-10 -7.797309756094118e-10 ] [ -4.270946410933534e-09 2.712880756639737e-10 1.433244848253599e-08 ] [ -5.792745996327212e-09 2.897549556565091e-09 -4.909038564557742e-09 ] [ -1.797028534891834e-09 -1.374805247726958e-08 -5.06716554636526e-09 ] [ 3.817843011905852e-09 -3.844448436435532e-10 -8.831012802885223e-09 ] [ -3.447039580664776e-09 9.102287900918568e-09 5.272205701588762e-10 ] [ 1.492214512893465e-08 2.722989049158027e-09 4.727278836722777e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.512943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.805882783600302e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1322822 2.3712161 1.7443658 ] [ 2.4414027 2.683505 5.0356517 ] [ 1.3712089 3.9096613 3.3842986 ] [ 3.2043638 1.1410463 3.3915031 ] [ 4.0280186 3.6630075 1.4079079 ] [ 3.2649484 5.2054471 3.0520082 ] [ 4.5586074 3.2025225 3.8086817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1322822e-10 2.3712161e-10 1.7443658e-10 ] [ 2.4414027e-10 2.683505e-10 5.0356517e-10 ] [ 1.3712089e-10 3.9096613e-10 3.3842986e-10 ] [ 3.2043638e-10 1.1410463e-10 3.3915031e-10 ] [ 4.028018600000001e-10 3.6630075e-10 1.4079079e-10 ] [ 3.2649484e-10 5.2054471e-10 3.0520082e-10 ] [ 4.5586074e-10 3.202522500000001e-10 3.8086817e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 3.5e-06 2.58e-05 ] [ -2.05e-05 -4.64e-05 -2.05e-05 ] [ 3.01e-05 -5.5e-06 1.56e-05 ] [ -2.87e-05 4.71e-05 1.46e-05 ] [ 3.9e-06 -8.1e-06 -7.69e-05 ] [ -1.85e-05 2.2e-06 8e-07 ] [ 2.03e-05 7.2e-06 4.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 5.6076181728e-15 4.133615681664e-14 ] [ -3.28446207264e-14 -7.434099520512001e-14 -3.28446207264e-14 ] [ 4.822551628608e-14 -8.8119714144e-15 2.499395528448e-14 ] [ -4.598246901696e-14 7.546251883968001e-14 2.339177866368e-14 ] [ 6.24848882112e-15 -1.297763062848e-14 -1.2320738213952e-13 ] [ -2.96402674848e-14 3.52478856576e-15 1.28174129664e-15 ] [ 3.252418540224e-14 1.153567166976e-14 6.504837080448e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.303661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573440421244875e-18 } }