{ "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" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4358149 -6.4293585 -1.7719408 ] [ -0.9942233 2.4193834 3.8850851 ] [ 1.1644109 2.888549 -1.0158957 ] [ 1.8811245 1.5675496 -1.1118827 ] [ 2.3599499 -0.7345239 0.8835663 ] [ -2.9754471 0.2884003 -0.8689321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.30042906457629e-09 -1.030096787544176e-08 -2.838962123201649e-09 ] [ -1.592921327114625e-09 3.876279520231614e-09 6.22459251703843e-09 ] [ 1.865591920984687e-09 4.62796567583522e-09 -1.627644339711251e-09 ] [ 3.01389369471409e-09 2.511491321064392e-09 -1.78143246701198e-09 ] [ 3.781056556039298e-09 -1.176837019998837e-09 1.415629268786759e-09 ] [ -4.767191780047159e-09 4.620682180917063e-10 -1.392182695682648e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.421588 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.791246099080983e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9471723 0.0664507 1.4097642 ] [ -0.1153685 1.701776 3.0050552 ] [ 0.4790997 2.4274801 0.5964061 ] [ 2.6972474 1.4021571 0.1416276 ] [ 3.3018912 0.1222155 2.3044479 ] [ 2.236085 2.4017234 2.4314535 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.471723e-11 6.64507e-12 1.4097642e-10 ] [ -1.153685e-11 1.701776e-10 3.0050552e-10 ] [ 4.790997e-11 2.4274801e-10 5.964061e-11 ] [ 2.6972474e-10 1.4021571e-10 1.416276e-11 ] [ 3.3018912e-10 1.222155e-11 2.3044479e-10 ] [ 2.236085e-10 2.4017234e-10 2.4314535e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.16e-05 0.000108 1.83e-05 ] [ 0.0001007 1.48e-05 -5.08e-05 ] [ 2.4e-05 -8.41e-05 6.6e-05 ] [ -1.5e-06 2.9e-05 0.0001 ] [ -7.66e-05 2.06e-05 -3.9e-05 ] [ -8.83e-05 -8.83e-05 -9.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.665054742528e-14 1.730350750464e-13 2.931983216064e-14 ] [ 1.6133918571456e-13 2.371221398784e-14 -8.139057233664001e-14 ] [ 3.84522388992e-14 -1.3474305380928e-13 1.057436569728e-13 ] [ -2.4032649312e-15 4.64631220032e-14 1.6021766208e-13 ] [ -1.2272672915328e-13 3.300483838848e-14 -6.248488821120001e-14 ] [ -1.4147219561664e-13 -1.4147219561664e-13 -1.514056906656e-13 ] ] } "relaxed-potential-energy" { "source-value" -20.62566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304595024056973e-18 } }