{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.616061 2.621535 1.403689 ] [ 0.7250895 5.039665 2.091083 ] [ 2.961807 4.812326 1.76803 ] [ 3.86556 2.819524 0.0440365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.616061e-10 2.621535000000001e-10 1.403689e-10 ] [ 7.250895e-11 5.039665000000001e-10 2.091083e-10 ] [ 2.961807e-10 4.812326e-10 1.76803e-10 ] [ 3.86556e-10 2.819524e-10 4.40365e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1538998 2.0637958 -0.269238 ] [ -0.5742489 -1.3136862 -0.3140019 ] [ 1.2939398 -1.7616612 -1.1423121 ] [ -1.8735907 1.0115516 1.725552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.848751297537273e-09 3.306565408107337e-09 -4.313668325848919e-10 ] [ -9.200481696802024e-10 -2.104757334048251e-09 -5.030865072116046e-10 ] [ 2.073120113362633e-09 -2.822492411664401e-09 -1.830185755355471e-09 ] [ -3.001823241219704e-09 1.620684337605314e-09 2.764639095151967e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4409854 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.512612620981514e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6434122 2.7342267 1.4346647 ] [ 0.7696025 4.867598 1.9650125 ] [ 3.1170275 4.7087092 1.7191593 ] [ 3.6384753 2.9825161 0.188002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6434122e-10 2.7342267e-10 1.4346647e-10 ] [ 7.696025e-11 4.867598e-10 1.9650125e-10 ] [ 3.1170275e-10 4.7087092e-10 1.7191593e-10 ] [ 3.6384753e-10 2.9825161e-10 1.88002e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.75e-05 -2.4e-06 7.9e-06 ] [ 2.08e-05 -7e-07 -2.14e-05 ] [ -1.05e-05 -1.89e-05 5.2e-06 ] [ -2.78e-05 2.2e-05 8.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.8038091095e-14 -3.845223921599999e-15 1.26571954086e-14 ] [ 3.332527398719999e-14 -1.1215236438e-15 -3.42865799676e-14 ] [ -1.6822854657e-14 -3.02811383826e-14 8.331318496799998e-15 ] [ -4.454051042519999e-14 3.5247885948e-14 1.31378483988e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }