{ "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" [ [ 2.924097 1.394529 2.047948 ] [ 0.8517503 3.0229 2.150903 ] [ 3.084941 2.892354 0.5199401 ] [ 2.119748 2.11188 4.047438 ] [ 4.365389 1.647318 4.564937 ] [ 3.247696 3.944508 2.731386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.924097e-10 1.394529e-10 2.047948e-10 ] [ 8.517503e-11 3.0229e-10 2.150903e-10 ] [ 3.084941000000001e-10 2.892354e-10 5.199401e-11 ] [ 2.119748e-10 2.11188e-10 4.047438e-10 ] [ 4.365389e-10 1.647318e-10 4.564937e-10 ] [ 3.247696e-10 3.944508e-10 2.731386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.9660673 -12.1598064 -2.6358559 ] [ -8.2010784 2.4159554 -1.5439489 ] [ 1.7559176 2.4998775 -6.1459474 ] [ -2.6191116 -1.2085848 7.0765985 ] [ 1.7749648 -0.2085155 0.9730056 ] [ 4.3232403 8.6610737 2.2761481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.75216368377938e-09 -1.948215752753422e-08 -4.223106698777743e-09 ] [ -1.313957607782787e-08 3.870787258775512e-09 -2.473678831289877e-09 ] [ 2.813290126771246e-09 4.005245285363952e-09 -9.846893236946546e-09 ] [ -4.196279372786081e-09 -1.936366310814244e-09 1.133796067148835e-08 ] [ 2.843807105302948e-09 -3.340786591744224e-10 1.558926824227477e-09 ] [ 6.926594534760379e-09 1.387656979316575e-08 3.646791271298341e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.853889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.258331733815829e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4071537 0.912584 1.9227252 ] [ 0.7796028 2.8181243 2.1464329 ] [ 2.8361659 3.0688387 0.9875439 ] [ 1.5109678 2.0981903 4.2859215 ] [ 3.867752 2.0531334 4.0052617 ] [ 4.191979 4.0626183 2.714667 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4071537e-10 9.12584e-11 1.9227252e-10 ] [ 7.796028e-11 2.8181243e-10 2.1464329e-10 ] [ 2.8361659e-10 3.0688387e-10 9.875439000000001e-11 ] [ 1.5109678e-10 2.0981903e-10 4.2859215e-10 ] [ 3.867752e-10 2.0531334e-10 4.0052617e-10 ] [ 4.191979e-10 4.0626183e-10 2.714667e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-06 -2.26e-05 1.71e-05 ] [ -4.3e-06 1.89e-05 -6.7e-06 ] [ -2.61e-05 6.3e-06 -1.6e-06 ] [ -2.14e-05 -2.03e-05 -1.81e-05 ] [ 3.5e-05 8.5e-06 8.1e-06 ] [ 1.48e-05 9.2e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-15 -3.620919163008e-14 2.739722021568e-14 ] [ -6.889359469440001e-15 3.028113813312e-14 -1.073458335936e-14 ] [ -4.181680980288e-14 1.009371271104e-14 -2.56348259328e-15 ] [ -3.428657968511999e-14 -3.252418540224e-14 -2.899939683648e-14 ] [ 5.6076181728e-14 1.36185012768e-14 1.297763062848e-14 ] [ 2.371221398784e-14 1.474002491136e-14 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.154569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.267811952930044e-18 } }