{ "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" [ [ 0.6628403 2.876785 2.898563 ] [ 2.674482 0.2424727 1.042802 ] [ 2.274992 1.1385 2.859862 ] [ 1.854823 2.68523 0.2527791 ] [ 2.130586 2.70202 1.965626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628403e-11 2.876785e-10 2.898563e-10 ] [ 2.674482e-10 2.424727e-11 1.042802e-10 ] [ 2.274992e-10 1.1385e-10 2.859862e-10 ] [ 1.854823e-10 2.68523e-10 2.527791e-11 ] [ 2.130586e-10 2.70202e-10 1.965626e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6353248 0.8656566 4.6542401 ] [ 0.1039191 -0.7751134 -2.869463 ] [ 0.4509651 -6.0122803 6.4699018 ] [ -1.1704486 -1.0332472 -9.5971189 ] [ 8.2508891 6.9549844 1.34244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.223313898756072e-08 1.386934777587884e-09 7.456914737245823e-09 ] [ 1.664967538463094e-10 -1.241868578180295e-09 -4.597386570727542e-09 ] [ 7.225257459694733e-10 -9.632735013718508e-09 1.036592548823454e-08 ] [ -1.875265398218012e-09 -1.655444520985925e-09 -1.537627965529978e-08 ] [ 1.321938172574529e-08 1.114311349551451e-08 2.15082600054696e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.949465832689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.929918507916746e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2472444 2.1904059 2.3642349 ] [ 2.3477646 0.4254263 0.9467475 ] [ 2.2745699 1.2437894 3.1832104 ] [ 1.5645198 2.6142098 0.4246405 ] [ 3.1636246 3.1711763 2.1007988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.472444e-11 2.1904059e-10 2.3642349e-10 ] [ 2.3477646e-10 4.254263e-11 9.467475e-11 ] [ 2.2745699e-10 1.2437894e-10 3.1832104e-10 ] [ 1.5645198e-10 2.6142098e-10 4.246405e-11 ] [ 3.1636246e-10 3.1711763e-10 2.1007988e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.02e-05 -1.2e-05 -1.9e-06 ] [ 5e-07 -7.4e-06 -3.4e-06 ] [ -5.5e-06 1.86e-05 -9.2e-06 ] [ 4.2e-06 4.8e-06 2.05e-05 ] [ 1.1e-05 -3.9e-06 -5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.63422016668e-14 -1.9226119608e-14 -3.0441356046e-15 ] [ 8.010883169999999e-16 -1.18561070916e-14 -5.4474005556e-15 ] [ -8.811971486999999e-15 2.98004853924e-14 -1.47400250328e-14 ] [ 6.729141862799999e-15 7.690447843199998e-15 3.2844620997e-14 ] [ 1.7623942974e-14 -6.248488872599999e-15 -9.452842140600001e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }