{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0714325 -3.7343548 -0.1522803 ] [ -2.0714325 3.7343548 0.1522803 ] [ 9.7735938 -13.3000513 0.7197815 ] [ -8.5830291 -2.5816445 -7.5773489 ] [ -0.2788358 0.1575809 4.9311966 ] [ -0.9117289 15.7241148 1.9263709 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.318800750408204e-09 -5.983096003625743e-09 -2.439799384785102e-10 ] [ -3.318800750408204e-09 5.983096003625743e-09 2.439799384785102e-10 ] [ 1.565902361656727e-08 -2.130903142386132e-08 1.153217100885471e-09 ] [ -1.375152867296205e-08 -4.136250495194613e-09 -1.21402513552456e-08 ] [ -4.467442034826972e-10 2.524724359446906e-10 7.900647970180243e-09 ] [ -1.460750740122522e-09 2.519280932289358e-08 3.08638644439755e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6619994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.469346506402019e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8750375 1.0679307 3.9068839 ] [ 1.7893175 3.0252543 3.9867001 ] [ 5.1317466 1.9140682 3.0012055 ] [ 3.1505028 2.54793 1.7562474 ] [ 4.4466613 2.8643166 5.1377896 ] [ 4.3147672 4.2541743 3.0639285 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8750375e-10 1.0679307e-10 3.9068839e-10 ] [ 1.7893175e-10 3.0252543e-10 3.9867001e-10 ] [ 5.1317466e-10 1.9140682e-10 3.0012055e-10 ] [ 3.1505028e-10 2.54793e-10 1.7562474e-10 ] [ 4.4466613e-10 2.8643166e-10 5.1377896e-10 ] [ 4.314767200000001e-10 4.2541743e-10 3.0639285e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.3460658 -0.6238835 -0.0254408 ] [ -0.3460658 0.6238835 0.0254408 ] [ 0.8217281 -1.3710324 -0.0760814 ] [ -0.6787041 -0.1451734 -0.8937267 ] [ 0.1126836 0.2242323 0.6922235 ] [ -0.2557076 1.2919735 0.2775846 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.544585385865171e-10 -9.99571566038139e-10 -4.076065531026719e-11 ] [ -5.544585385865171e-10 9.99571566038139e-10 4.076065531026719e-11 ] [ 1.316553561321215e-09 -2.196636075736941e-09 -1.218958413620076e-10 ] [ -1.087403850419999e-09 -2.325934293583356e-10 -1.431908035921928e-09 ] [ 1.805390309550024e-10 3.592597516480782e-10 1.109064317205699e-09 ] [ -4.096887418562183e-10 2.069969753447199e-09 4.447395600782364e-10 ] ] } "relaxed-potential-energy" { "source-value" -9.889801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.584520807710983e-18 } }