{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8761006 -2.2176469 -3.0573099 ] [ -6.0638998 3.203784 -2.0987669 ] [ -3.8487473 -3.6799497 3.4904271 ] [ -1.2116733 0.3843745 0.953365 ] [ 5.7275377 -1.5106761 0.1845102 ] [ 3.9982836 0.8923276 -2.5537247 ] [ 2.2745998 2.9277866 3.0814991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.40366791035338e-09 -3.553062045642535e-09 -4.898350484676877e-09 ] [ -9.715438570477273e-09 5.133027865183056e-09 -3.362595287392615e-09 ] [ -6.166372994230587e-09 -5.89592942363531e-09 5.59228074230038e-09 ] [ -1.941314649301672e-09 6.158358426054329e-10 1.52745912667341e-09 ] [ 9.176527073294102e-09 -2.420369948962247e-09 2.956179311746668e-10 ] [ 6.405956560025402e-09 1.429666430593298e-09 -4.091518044008659e-09 ] [ 3.644310651261073e-09 4.690831279858305e-09 4.937105855712029e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.491116 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.321732745578354e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0878365 2.6193807 0.9981035 ] [ 1.6934949 4.9873564 1.8478235 ] [ 2.1690682 2.964066 3.5198923 ] [ 4.4703494 3.0769888 0.874208 ] [ 4.7006064 2.828263 3.2796679 ] [ 4.0810734 5.4640254 1.1014466 ] [ 3.6991401 5.1476987 3.5992224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0878365e-10 2.6193807e-10 9.981035000000001e-11 ] [ 1.6934949e-10 4.987356400000001e-10 1.8478235e-10 ] [ 2.1690682e-10 2.964066e-10 3.5198923e-10 ] [ 4.4703494e-10 3.0769888e-10 8.74208e-11 ] [ 4.7006064e-10 2.828263e-10 3.2796679e-10 ] [ 4.0810734e-10 5.4640254e-10 1.1014466e-10 ] [ 3.6991401e-10 5.1476987e-10 3.5992224e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 7.9e-06 3.8e-06 ] [ 7.9e-06 -6.8e-06 2.9e-06 ] [ -4.8e-06 -1.29e-05 5.6e-06 ] [ 6e-07 -7.4e-06 -9.1e-06 ] [ -8.1e-06 3.1e-06 -2e-07 ] [ 3.4e-06 6.1e-06 -2.8e-06 ] [ -1.9e-06 1e-05 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-15 1.26571954086e-14 6.088271209199999e-15 ] [ 1.26571954086e-14 -1.08948011112e-14 4.6463122386e-15 ] [ -7.690447843199998e-15 -2.06680785786e-14 8.972189150399999e-15 ] [ 9.613059803999998e-16 -1.18561070916e-14 -1.45798073694e-14 ] [ -1.29776307354e-14 4.9667475654e-15 -3.204353268e-16 ] [ 5.4474005556e-15 9.773277467399999e-15 -4.486094575199999e-15 ] [ -3.0441356046e-15 1.602176634e-14 -1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.482183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.800954511391202e-18 } }