{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5595937 -0.1218882 -4.2233697 ] [ 3.6838134 2.6930048 -3.0138023 ] [ -2.3487156 -2.2818133 -0.9921048 ] [ -0.7144861 -0.8006925 0.7663532 ] [ 1.9339616 0.0792879 3.0582146 ] [ -2.233543 -0.3655113 4.266579 ] [ 1.2385635 0.7976126 0.13813 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.498744564086969e-09 -1.952864243913946e-10 -6.76658419433511e-09 ] [ 5.902119704869759e-09 4.31466933026218e-09 -4.828643584773268e-09 ] [ -3.763057223228244e-09 -3.655867922290497e-09 -1.58952711594346e-09 ] [ -1.144732925306571e-09 -1.282850803949904e-09 1.227833180315266e-09 ] [ 3.098548061044961e-09 1.270332196923283e-10 4.899799933509224e-09 ] [ -3.578530376151494e-09 -5.85613659498215e-10 6.835813124596244e-09 ] [ 1.984397483076221e-09 1.277916260175502e-09 2.21308656631104e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.73168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.161363638510695e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4662683 2.3572121 1.8830176 ] [ 2.5270431 4.883421 4.0177463 ] [ 1.0175109 3.0863048 3.6597408 ] [ 4.6937744 2.6059899 1.0092172 ] [ 3.391345 2.5979845 4.2148113 ] [ 3.5462389 4.6341799 1.8759859 ] [ 5.3169344 3.4868977 3.1239639 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4662683e-10 2.3572121e-10 1.8830176e-10 ] [ 2.5270431e-10 4.883421e-10 4.0177463e-10 ] [ 1.0175109e-10 3.0863048e-10 3.6597408e-10 ] [ 4.6937744e-10 2.6059899e-10 1.0092172e-10 ] [ 3.391345e-10 2.5979845e-10 4.2148113e-10 ] [ 3.5462389e-10 4.6341799e-10 1.8759859e-10 ] [ 5.316934400000001e-10 3.4868977e-10 3.1239639e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.21e-05 -9.2e-06 2.36e-05 ] [ 1.72e-05 -4.3e-06 -2.94e-05 ] [ 2.26e-05 2e-06 -5.8e-06 ] [ -3e-06 3.56e-05 2.39e-05 ] [ -1.8e-06 -4.33e-05 1.02e-05 ] [ 1.8e-06 1.88e-05 -3.64e-05 ] [ -4.7e-06 4e-07 1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.142986952768e-14 -1.474002491136e-14 3.781136825088e-14 ] [ 2.755743787776e-14 -6.889359469440001e-15 -4.710399265152e-14 ] [ 3.620919163008e-14 3.2043532416e-15 -9.292624400640001e-15 ] [ -4.8065298624e-15 5.703748770048e-14 3.829202123712e-14 ] [ -2.88391791744e-15 -6.937424768064e-14 1.634220153216e-14 ] [ 2.88391791744e-15 3.012092047104e-14 -5.831922899712e-14 ] [ -7.53023011776e-15 6.408706483200001e-16 2.227025502912e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.639617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.467048844046624e-18 } }