{ "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" [ [ -4.8098652 -2.7888664 -2.8504999 ] [ 0.0 0.0 0.0 ] [ 9.1622701 -10.2182589 0.2068608 ] [ -5.9030751 7.1821447 -5.2496369 ] [ 1.5506702 5.8249806 7.893276 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.706253572639517e-09 -4.468256544614661e-09 -4.567004297372738e-09 ] [ 0.0 0.0 0.0 ] [ 1.467957494767488e-08 -1.637145551486153e-08 3.314275375199846e-10 ] [ -9.457768916046622e-09 1.150706432554263e-08 -8.410845508868986e-09 ] [ 2.48444754101126e-09 9.332647733933558e-09 1.264642226872174e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.8585146 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.579845262335463e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.3933957 1.4114005 -0.733184 ] [ 0.0667642 0.1957144 2.535937 ] [ 4.6668337 1.0845089 2.7836152 ] [ 1.1096116 2.2131124 0.6616382 ] [ 2.9142928 2.0950067 1.9153824 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.933957e-11 1.4114005e-10 -7.331839999999999e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 4.6668337e-10 1.0845089e-10 2.7836152e-10 ] [ 1.1096116e-10 2.2131124e-10 6.616382e-11 ] [ 2.9142928e-10 2.0950067e-10 1.9153824e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1061561 0.1095159 0.1191209 ] [ 0.0 0.0 0.0 ] [ -0.1102111 0.108279 -0.0371582 ] [ -0.1945278 -0.1043426 -0.1807376 ] [ 0.1985827 -0.1134523 0.0987749 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.700808215753069e-10 1.754638145858707e-10 1.908527210286547e-10 ] [ 0.0 0.0 0.0 ] [ -1.765776477726509e-10 1.734820823236032e-10 -5.953399931101057e-11 ] [ -3.116678932556583e-10 -1.671752742734861e-10 -2.895735572195021e-10 ] [ 3.181645592353402e-10 -1.817706226359878e-10 1.582548355018579e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3942695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.344910234159451e-18 } }