{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7299116 0.7251137 1.9468252 ] [ 3.6993808 -23.7090159 7.4013968 ] [ -5.6930829 19.9769924 -7.7794046 ] [ -20.8479867 -44.3779739 -43.689221 ] [ 21.7378938 33.2759518 43.021942 ] [ 0.3738834 14.1089319 -0.9015384 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169447300770721e-09 1.161760217561785e-09 3.119157820224284e-09 ] [ 5.927061429196401e-09 -3.798603097715547e-08 1.185834491422393e-08 ] [ -9.121324322656265e-09 3.200667017717929e-08 -1.246398017386398e-08 ] [ -3.340215688148934e-08 -7.11013522610526e-08 -6.99978484671644e-08 ] [ 3.482794523179327e-08 5.331395200882769e-08 6.89287496538136e-08 ] [ 5.990272423852148e-10 2.260500083463932e-08 -1.444423747233439e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.8820673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.21975746843218e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0950519 0.6667105 0.6134203 ] [ 0.7997416 0.556018 2.9608537 ] [ 0.0517064 2.6469039 1.9754361 ] [ 2.1960536 -0.3678375 1.1675087 ] [ 3.1575874 1.1175443 2.7945354 ] [ 2.2725605 3.213936 2.3388446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.50519e-12 6.667105e-11 6.134203e-11 ] [ 7.997416000000001e-11 5.560180000000001e-11 2.9608537e-10 ] [ 5.17064e-12 2.6469039e-10 1.9754361e-10 ] [ 2.1960536e-10 -3.678375e-11 1.1675087e-10 ] [ 3.1575874e-10 1.1175443e-10 2.7945354e-10 ] [ 2.2725605e-10 3.213936e-10 2.3388446e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 9.7e-06 5.9e-06 ] [ -2.9e-06 -9.1e-06 -9e-07 ] [ 1.3e-06 -9.5e-06 5e-06 ] [ -2e-06 -2.3e-06 -8.2e-06 ] [ -8.2e-06 8.1e-06 1.27e-05 ] [ 7.6e-06 3.1e-06 -1.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.72914180736e-15 1.554111322176e-14 9.45284206272e-15 ] [ -4.646312200320001e-15 -1.457980724928e-14 -1.44195895872e-15 ] [ 2.08282960704e-15 -1.52206778976e-14 8.010883104e-15 ] [ -3.2043532416e-15 -3.68500622784e-15 -1.313784829056e-14 ] [ -1.313784829056e-14 1.297763062848e-14 2.034764308416e-14 ] [ 1.217654231808e-14 4.96674752448e-15 -2.32315610016e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.34272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.938827714588058e-18 } }