{ "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" [ [ 1.617948 3.024291 1.012928 ] [ 1.30973 1.622672 3.703727 ] [ 2.879916 3.04735 3.836046 ] [ 0.9226834 3.798669 3.025472 ] [ 3.183378 1.61886 2.358361 ] [ 3.567629 4.016165 2.010815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.617948e-10 3.024291e-10 1.012928e-10 ] [ 1.30973e-10 1.622672e-10 3.703727e-10 ] [ 2.879916000000001e-10 3.04735e-10 3.836046e-10 ] [ 9.226834e-11 3.798669e-10 3.025472e-10 ] [ 3.183378e-10 1.61886e-10 2.358361e-10 ] [ 3.567629e-10 4.016165e-10 2.010815e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5837231 -0.6054664 -1.6044338 ] [ -4.2443753 -5.2996756 2.1964121 ] [ 4.2681484 2.4582363 8.0839384 ] [ -4.6730344 3.9363256 -0.6113968 ] [ 1.6805303 -3.6117244 -4.264162 ] [ 2.3850079 3.1223046 -3.8003579 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.352275115460454e-10 -9.700641187520976e-10 -2.570586345159829e-09 ] [ -6.800238931586739e-09 -8.491016414099929e-09 3.519040145254871e-09 ] [ 6.838327636924486e-09 3.938528760710613e-09 1.295189721517534e-08 ] [ -7.487026525558208e-09 6.30668890013603e-09 -9.795656670623711e-10 ] [ 2.69250637938901e-09 -5.786620442127669e-09 -6.831940719990707e-09 ] [ 3.821203929285409e-09 5.002483474350716e-09 -6.088844628217308e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.70679505564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.875635349717733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7733785 2.7671766 0.8001686 ] [ 1.2399426 1.6370324 3.5012192 ] [ 2.9362171 3.1540531 4.0675587 ] [ 0.8551619 3.9623676 3.37838 ] [ 3.2154021 1.6484948 2.2590258 ] [ 3.4611823 3.9588825 1.9409968 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7733785e-10 2.7671766e-10 8.001686000000001e-11 ] [ 1.2399426e-10 1.6370324e-10 3.5012192e-10 ] [ 2.9362171e-10 3.1540531e-10 4.067558700000001e-10 ] [ 8.551619e-11 3.9623676e-10 3.37838e-10 ] [ 3.2154021e-10 1.6484948e-10 2.2590258e-10 ] [ 3.4611823e-10 3.9588825e-10 1.9409968e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.97e-05 7.9e-05 1.43e-05 ] [ -2.05e-05 -6.68e-05 3.94e-05 ] [ 7.33e-05 9.72e-05 0.0001673 ] [ -0.0001311 -7e-07 -5.74e-05 ] [ 9.6e-06 -0.0001453 -9.02e-05 ] [ 9.84e-05 3.65e-05 -7.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.75846460298e-14 1.26571954086e-13 2.29111258662e-14 ] [ -3.2844620997e-14 -1.070253991512e-13 6.31257593796e-14 ] [ 1.174395472722e-13 1.557315688248e-13 2.680441508682e-13 ] [ -2.100453567174e-13 -1.1215236438e-15 -9.196493879159998e-14 ] [ 1.53808956864e-14 -2.327962649202e-13 -1.445163323868e-13 ] [ 1.576541807856e-13 5.847944714099999e-14 -1.174395472722e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.10006605564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.419297300620715e-18 } }