{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7570375 -4.0072404 -60.1587741 ] [ -24.5246169 -29.9756441 55.169854 ] [ 2.1969598 8.4346723 -72.5092252 ] [ 87.7233952 -10.3136695 46.135806 ] [ -63.6387006 35.8618817 31.3623393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.81508440436888e-09 -6.42030688280524e-09 -9.638498139900856e-08 ] [ -3.929276783125657e-08 -4.802627617044146e-08 8.839185025174938e-08 ] [ 3.519917628397444e-09 1.351383476316936e-08 -1.161725854077622e-07 ] [ 1.405483728866389e-07 -1.652432014755803e-08 7.391770975496437e-08 ] [ -1.019604382794109e-07 5.745706843763536e-08 5.024800680005703e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 58.669212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.399843982715882e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8446381 0.5458132 0.5209759 ] [ 0.0883054 0.8938907 2.7205327 ] [ 2.7422903 1.8934201 0.1831682 ] [ 3.1587983 3.0742968 2.1739673 ] [ 1.5191168 2.4558378 3.742465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.446381e-11 5.458132e-11 5.209759e-11 ] [ 8.830540000000002e-12 8.938907000000001e-11 2.7205327e-10 ] [ 2.7422903e-10 1.8934201e-10 1.831682e-11 ] [ 3.1587983e-10 3.0742968e-10 2.1739673e-10 ] [ 1.5191168e-10 2.4558378e-10 3.742465e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-06 3.06e-05 2.03e-05 ] [ 4.2e-06 -3.28e-05 1.86e-05 ] [ -2.42e-05 -1.41e-05 -2.17e-05 ] [ 5.56e-05 1.47e-05 2.9e-05 ] [ -3.99e-05 1.7e-06 -4.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.889359469440001e-15 4.902660459647999e-14 3.252418540224e-14 ] [ 6.72914180736e-15 -5.255139316223999e-14 2.980048514688e-14 ] [ -3.877267422336e-14 -2.259069035328e-14 -3.476723267136e-14 ] [ 8.908102011648e-14 2.355199632576e-14 4.64631220032e-14 ] [ -6.392684716992e-14 2.72370025536e-15 -7.402055988096e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }