{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6603633 -6.9450428 -4.5305054 ] [ -9.2860503 3.3109836 7.0313783 ] [ -0.5708589 1.6723929 -15.3453523 ] [ 11.1529445 -10.3094537 6.761534 ] [ 3.364328 12.2711201 6.0829454 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.466725123694337e-09 -1.112718520461537e-08 -7.258669832288153e-09 ] [ -1.487789269023283e-08 5.304780515772219e-09 1.126550992426045e-08 ] [ -9.146167833556051e-10 2.679468805171913e-09 -2.458596469299951e-08 ] [ 1.786898693097995e-08 -1.651756569136006e-08 1.083317169554431e-08 ] [ 5.390247666302822e-09 1.966050173524896e-08 9.745952905482904e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.5653558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.110153086793681e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3710065 0.7524293 0.7436631 ] [ 2.2563757 2.2491099 2.7891854 ] [ 4.0052901 2.4778391 -0.1448342 ] [ 4.5968701 1.2750519 2.1112048 ] [ 4.0263596 3.8737751 1.9737214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3710065e-10 7.524293e-11 7.436631e-11 ] [ 2.2563757e-10 2.2491099e-10 2.7891854e-10 ] [ 4.0052901e-10 2.4778391e-10 -1.448342e-11 ] [ 4.596870100000001e-10 1.2750519e-10 2.1112048e-10 ] [ 4.0263596e-10 3.8737751e-10 1.9737214e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 -1.2e-06 4.2e-06 ] [ -1.56e-05 6.3e-06 2.01e-05 ] [ 1.74e-05 6.7e-06 -1.34e-05 ] [ 8.9e-06 -1.24e-05 -6.9e-06 ] [ -8.9e-06 6e-07 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 -1.92261194496e-15 6.72914180736e-15 ] [ -2.499395528448e-14 1.009371271104e-14 3.220375007808e-14 ] [ 2.787787320192e-14 1.073458335936e-14 -2.146916671872e-14 ] [ 1.425937192512e-14 -1.986699009792e-14 -1.105501868352e-14 ] [ -1.425937192512e-14 9.6130597248e-16 -6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.43983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672645155112647e-18 } }