{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.9553769 1.7038029 -2.5254085 ] [ -0.7794654 -0.4419881 -1.0496874 ] [ 6.3077884 3.1873219 -0.4220472 ] [ -4.6768421 -4.445837 7.1846867 ] [ -5.1574956 7.8572717 0.809889 ] [ 0.7092374 -8.6372678 3.618394 ] [ -6.3585996 0.7766963 -7.6158267 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.595027212043238e-08 2.729793172831241e-09 -4.046150456669597e-09 ] [ -1.24884124060252e-09 -7.081430004918125e-10 -1.681784611428338e-09 ] [ 1.010619110343344e-08 5.106652631143836e-09 -6.761941567141018e-10 ] [ -7.493127071793176e-09 -7.123016101287611e-09 1.15111370585127e-08 ] [ -8.263218872198868e-09 1.258873702101347e-08 1.297585221243091e-09 ] [ 1.136323580876978e-09 -1.383842853674865e-08 5.797306271642995e-09 ] [ -1.018759962014823e-08 1.244404653321863e-09 -1.220189948680442e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -35.54793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.695406236383495e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5547347 1.0419714 2.2609549 ] [ 1.3179284 1.3219753 4.068034 ] [ 2.1959105 2.9356348 5.3122817 ] [ 2.3025742 3.0655786 3.1102985 ] [ 4.5700968 0.2813166 2.7475114 ] [ 4.2751939 2.4422503 2.3396963 ] [ 3.5110465 1.5487156 4.2102792 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5547347e-10 1.0419714e-10 2.2609549e-10 ] [ 1.3179284e-10 1.3219753e-10 4.068034e-10 ] [ 2.1959105e-10 2.9356348e-10 5.3122817e-10 ] [ 2.3025742e-10 3.0655786e-10 3.1102985e-10 ] [ 4.5700968e-10 2.813166e-11 2.7475114e-10 ] [ 4.2751939e-10 2.4422503e-10 2.3396963e-10 ] [ 3.5110465e-10 1.5487156e-10 4.210279200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.36e-05 -4.41e-05 -2.64e-05 ] [ 3.04e-05 -0.0003361 -8.91e-05 ] [ -0.0001412 0.0003327 0.0002427 ] [ 1.53e-05 6.83e-05 -5.58e-05 ] [ -0.0003066 0.000159 1.2e-05 ] [ 0.0001909 -4.05e-05 -2.1e-06 ] [ 0.0002447 -0.0001393 -8.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.383313445888e-14 -7.065598897728e-14 -4.229746278912e-14 ] [ 4.870616927232e-14 -5.3849156225088e-13 -1.4275393691328e-13 ] [ -2.2622733885696e-13 5.3304416174016e-13 3.8884826586816e-13 ] [ 2.451330229824e-14 1.0942866320064e-13 -8.940145544064e-14 ] [ -4.9122735193728e-13 2.547460827072e-13 1.92261194496e-14 ] [ 3.0585551691072e-13 -6.488815314240001e-14 -3.36457090368e-15 ] [ 3.9205261910976e-13 -2.2318320327744e-13 -1.3025695927104e-13 ] ] } "relaxed-potential-energy" { "source-value" -49.241665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.889384443226563e-18 } }