{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6903658 -6.7259271 -1.9639854 ] [ 0.0051284 -0.1707249 -1.3222495 ] [ 17.9230698 -24.5088379 -3.6738362 ] [ -14.2613299 17.1815065 -17.4465376 ] [ 5.0234975 14.2239835 24.4066088 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.392350091095989e-08 -1.077612315282514e-08 -3.146651491472536e-09 ] [ 8.21660258211072e-12 -2.735314433684179e-10 -2.11847723576449e-09 ] [ 2.871592340652653e-08 -3.926748708635696e-08 -5.886134468288713e-09 ] [ -2.2849169347296e-08 2.752780802442324e-08 -2.795243465662814e-08 ] [ 8.04853024914725e-09 2.278933381834495e-08 3.910369801237155e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.26978056 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.322361059783317e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.1281995 0.6761696 0.5769301 ] [ -0.4966076 -0.1955292 2.1095143 ] [ 3.3354587 0.4028341 1.6809717 ] [ 1.0480001 3.1463636 0.8163428 ] [ 3.349056 2.969905 1.97963 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1281995e-10 6.761696000000001e-11 5.769301e-11 ] [ -4.966076e-11 -1.955292e-11 2.1095143e-10 ] [ 3.335458700000001e-10 4.028341e-11 1.6809717e-10 ] [ 1.0480001e-10 3.1463636e-10 8.163428000000001e-11 ] [ 3.349056e-10 2.969905e-10 1.97963e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.82e-05 -2.66e-05 9.4e-06 ] [ 3.4e-05 1.45e-05 -2.2e-05 ] [ 5.7e-06 -1e-05 1e-05 ] [ -7.3e-06 1.71e-05 -5e-07 ] [ 5.8e-06 4.9e-06 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.120314691456e-14 -4.261789811328e-14 1.506046023552e-14 ] [ 5.44740051072e-14 2.32315610016e-14 -3.52478856576e-14 ] [ 9.13240673856e-15 -1.6021766208e-14 1.6021766208e-14 ] [ -1.169588933184e-14 2.739722021568e-14 -8.010883104e-16 ] [ 9.292624400640001e-15 7.850665441919999e-15 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }