{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.5969577 5.1778774 0.0468096 ] [ 8.9890875 4.3088084 -2.2125132 ] [ -8.3977641 -11.1850118 1.675945 ] [ -2.0921546 -4.3901585 2.1124263 ] [ -4.0961265 6.0884845 -1.6226677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.96731477454654e-09 8.29587411564869e-09 7.499724674899968e-11 ] [ 1.440210583482552e-08 6.903472081986655e-09 -3.544836922251395e-09 ] [ -1.345470130801355e-08 -1.792036440933213e-08 2.685159896746656e-09 ] [ -3.352001187219176e-09 -7.033809310306397e-09 3.384480031023047e-09 ] [ -6.562718114139331e-09 9.754827522003178e-09 -2.599800252267308e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7083396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.145768250706824e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.841276 2.5316015 0.3437645 ] [ 2.5291558 6.3911734 4.5542187 ] [ 3.7652912 4.6822031 3.9344353 ] [ 2.6557234 2.7678126 -1.4960685 ] [ 4.3008586 3.2065774 2.3883862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.841276e-10 2.5316015e-10 3.437645e-11 ] [ 2.5291558e-10 6.3911734e-10 4.5542187e-10 ] [ 3.7652912e-10 4.6822031e-10 3.9344353e-10 ] [ 2.6557234e-10 2.7678126e-10 -1.4960685e-10 ] [ 4.3008586e-10 3.2065774e-10 2.3883862e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0830007 0.0501574 -0.070367 ] [ -0.0280749 0.0912152 0.105132 ] [ 0.1202162 -0.2838561 -0.2648986 ] [ 0.1137888 -0.0770255 0.0821791 ] [ -0.1229293 0.219509 0.1479545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.329817810500346e-10 8.036101364011393e-11 -1.127403622758336e-10 ] [ -4.498094841129792e-11 1.461428609015962e-10 1.684400324979456e-10 ] [ 1.926075850814169e-10 -4.547876070914668e-10 -4.244143438026508e-10 ] [ 1.82309755068887e-10 -1.234084553054304e-10 1.316654327383853e-10 ] [ -1.969544504713095e-10 3.516921878551872e-10 2.370492408421536e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.087759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.776454824686479e-18 } }