{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4152031 -1.4492017 0.6946599 ] [ 0.5796062 0.1342516 -1.1303725 ] [ 3.5677899 -6.6978992 -0.7975448 ] [ -3.6019513 4.7595175 -3.887858 ] [ 0.8697583 3.2533318 5.1211154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.267405320503684e-09 -2.321877082563615e-09 1.112967851187266e-09 ] [ 9.286315029107289e-10 2.150947748249933e-10 -1.811056392295248e-09 ] [ 5.716229565706371e-09 -1.073121750671502e-08 -1.277807632600612e-09 ] [ -5.770962162120167e-09 7.625587664788466e-09 -6.229035192590247e-09 ] [ 1.393506414006753e-09 5.212412149665183e-09 8.20493136629884e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.316529 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.17223717092052e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0364955 0.8320881 0.1966584 ] [ 0.4120234 -0.1089831 2.3541257 ] [ 2.7381555 0.4500131 1.8993424 ] [ 1.2720055 3.096695 0.5393982 ] [ 2.9054267 2.7299299 2.1738641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0364955e-10 8.320881e-11 1.966584e-11 ] [ 4.120234e-11 -1.089831e-11 2.3541257e-10 ] [ 2.7381555e-10 4.500131e-11 1.8993424e-10 ] [ 1.2720055e-10 3.096695e-10 5.393982000000001e-11 ] [ 2.9054267e-10 2.7299299e-10 2.1738641e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 2.07e-05 -1.08e-05 ] [ -1.16e-05 -5.7e-06 7.8e-06 ] [ 8.5e-06 1.45e-05 8.4e-06 ] [ -3.7e-06 -1.67e-05 6.2e-06 ] [ 5e-07 -1.28e-05 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.009371271104e-14 3.316505605055999e-14 -1.730350750464e-14 ] [ -1.858524880128e-14 -9.13240673856e-15 1.249697764224e-14 ] [ 1.36185012768e-14 2.32315610016e-14 1.345828361472e-14 ] [ -5.928053496960001e-15 -2.675634956736e-14 9.93349504896e-15 ] [ 8.010883104e-16 -2.050786074624e-14 -1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }