{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.693951 4.828533 2.524683 ] [ 0.9874005 3.253704 2.692751 ] [ 1.797506 3.29632 4.784436 ] [ 3.246699 2.730573 2.280252 ] [ 4.077425 2.843272 4.278983 ] [ 4.93943 4.110777 2.41493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.693951e-10 4.828533000000001e-10 2.524683e-10 ] [ 9.874005e-11 3.253704e-10 2.692751e-10 ] [ 1.797506e-10 3.29632e-10 4.784436000000001e-10 ] [ 3.246699e-10 2.730573e-10 2.280252e-10 ] [ 4.077425e-10 2.843272e-10 4.278983e-10 ] [ 4.93943e-10 4.110777e-10 2.41493e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6766996 2.0234786 1.393009 ] [ -1.866949 0.0579775 -1.0926943 ] [ 1.1400507 0.6711478 -0.7134018 ] [ -1.3499253 -4.1177699 -2.4302687 ] [ 1.7475527 0.2955312 2.3177213 ] [ 1.0059706 1.0696349 0.5256345 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.084192278424712e-09 3.241970105609115e-09 2.231846452363987e-09 ] [ -2.99118204002594e-09 9.2890195032432e-11 -1.750689261141421e-09 ] [ 1.826562578066674e-09 1.075297314261354e-09 -1.142995685196638e-09 ] [ -2.162818755486426e-09 -6.597394663613954e-09 -3.89371969340201e-09 ] [ 2.799888079555916e-09 4.73493179356969e-10 3.713398880390183e-09 ] [ 1.611742576532148e-09 1.713744029571746e-09 8.421593069858976e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -24.128318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.865782699882782e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7718287 5.010479 3.2293226 ] [ 1.1245285 3.5209949 2.2949172 ] [ 1.8799238 3.0601753 4.4591734 ] [ 3.097293 2.1541471 2.5075655 ] [ 4.2243599 3.3545108 4.3516267 ] [ 4.6444776 3.9628719 2.1334295 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7718287e-10 5.010479e-10 3.2293226e-10 ] [ 1.1245285e-10 3.5209949e-10 2.2949172e-10 ] [ 1.8799238e-10 3.0601753e-10 4.4591734e-10 ] [ 3.097293e-10 2.1541471e-10 2.5075655e-10 ] [ 4.2243599e-10 3.3545108e-10 4.3516267e-10 ] [ 4.6444776e-10 3.9628719e-10 2.1334295e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-05 1.9e-06 -4.7e-06 ] [ 3.04e-05 -1.05e-05 5e-06 ] [ -3.51e-05 2.42e-05 1.26e-05 ] [ -1.83e-05 -1.64e-05 -9e-07 ] [ 3.88e-05 -1.98e-05 -3.84e-05 ] [ 1.02e-05 2.06e-05 2.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-14 3.04413557952e-15 -7.53023011776e-15 ] [ 4.870616927232e-14 -1.68228545184e-14 8.010883104e-15 ] [ -5.623639939008e-14 3.877267422336e-14 2.018742542208e-14 ] [ -2.931983216064e-14 -2.627569658112e-14 -1.44195895872e-15 ] [ 6.216445288704e-14 -3.172309709184e-14 -6.152358223872e-14 ] [ 1.634220153216e-14 3.300483838848e-14 4.24576804512e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }