{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6421441 -2.8439229 -5.0002325 ] [ -7.1731133 -11.6685962 4.9892378 ] [ -0.0210396 2.6308596 -2.4913084 ] [ -3.6490304 1.6087892 0.5584656 ] [ 0.6385978 -1.3573402 -0.432945 ] [ -0.1198679 1.4721671 -0.1787585 ] [ 10.9665977 10.1580433 2.5555411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.028828272680959e-09 -4.556466819277518e-09 -8.011255676067404e-09 ] [ -1.149259452229463e-08 -1.869515218322119e-08 7.993640224629564e-09 ] [ -3.37091555087064e-11 4.215101778454586e-09 -3.991516106567925e-09 ] [ -5.846391243635673e-09 2.577564465271553e-09 8.947605352127904e-10 ] [ 1.023146473683805e-09 -2.174698752828887e-09 -6.9365436280713e-10 ] [ -1.920495485466486e-10 2.358671728963541e-09 -2.864026918288889e-10 ] [ 1.757042658941814e-08 1.627497962242025e-08 4.094428237646657e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.517262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.685051143005611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4741821 0.1205948 3.0336815 ] [ 2.4048978 1.345462 4.6590859 ] [ 3.3063573 4.6703993 2.7923372 ] [ 1.2133405 4.8557745 6.2238851 ] [ 4.4748964 1.1848031 1.26046 ] [ 4.3842711 3.4777473 1.1487775 ] [ 2.2872108 3.647676 4.5906924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4741821e-10 1.205948e-11 3.0336815e-10 ] [ 2.4048978e-10 1.345462e-10 4.6590859e-10 ] [ 3.3063573e-10 4.6703993e-10 2.7923372e-10 ] [ 1.2133405e-10 4.8557745e-10 6.2238851e-10 ] [ 4.474896400000001e-10 1.1848031e-10 1.26046e-10 ] [ 4.384271100000001e-10 3.4777473e-10 1.1487775e-10 ] [ 2.2872108e-10 3.647676e-10 4.5906924e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-05 1.94e-05 -2.71e-05 ] [ -1.37e-05 2.06e-05 2.51e-05 ] [ -2.83e-05 -3.15e-05 -1.15e-05 ] [ 3.86e-05 -2.13e-05 8.6e-06 ] [ -1.53e-05 1.02e-05 3.39e-05 ] [ 4.6e-05 9e-07 -1.69e-05 ] [ -3.83e-05 1.6e-06 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-14 3.10822266996e-14 -4.34189867814e-14 ] [ -2.19498198858e-14 3.300483866039999e-14 4.02146335134e-14 ] [ -4.53415987422e-14 -5.046856397099999e-14 -1.8425031291e-14 ] [ 6.18440180724e-14 -3.41263623042e-14 1.37787190524e-14 ] [ -2.45133025002e-14 1.63422016668e-14 5.431378789259999e-14 ] [ 7.370012516399999e-14 1.4419589706e-15 -2.70767851146e-14 ] [ -6.13633650822e-14 2.5634826144e-15 -1.9226119608e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.418821 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.951020463202852e-18 } }