{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1291037 -1.0714713 0.2227936 ] [ -6.5973014 -7.6822952 -0.9157746 ] [ -10.3738926 3.652723 8.6771531 ] [ -1.5425802 1.2875868 -0.866874 ] [ 3.3162484 -1.8903247 -6.4644112 ] [ 11.4850244 -2.4684104 5.1199117 ] [ 3.8416051 8.1721917 -5.7727986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.068469315029457e-10 -1.716686280861604e-09 3.569547001247423e-10 ] [ -1.057004215053549e-08 -1.230839386493036e-08 -1.467232666130696e-09 ] [ -1.662080832734551e-08 5.852307441074381e-09 1.390233194646066e-08 ] [ -2.471485952511046e-09 2.062941485206831e-09 -1.388885267422116e-09 ] [ 5.313215699019886e-09 -3.028634065013059e-09 -1.03571285772079e-08 ] [ 1.840103773459987e-08 -3.954829466002593e-09 8.203002893883218e-09 ] [ 6.154929928275233e-09 1.309329459030874e-08 -9.24904302970791e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.365025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660660086582585e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1742426 1.6708695 1.8392775 ] [ 2.1408513 0.144353 3.5512662 ] [ 2.4075532 2.0214105 5.1238355 ] [ 1.6508682 3.5756313 3.3690511 ] [ 4.5438296 0.2880366 2.9183885 ] [ 4.7295835 2.3121642 4.3550124 ] [ 4.0075566 4.0434936 2.7189608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1742426e-10 1.6708695e-10 1.8392775e-10 ] [ 2.1408513e-10 1.44353e-11 3.5512662e-10 ] [ 2.4075532e-10 2.0214105e-10 5.1238355e-10 ] [ 1.6508682e-10 3.5756313e-10 3.3690511e-10 ] [ 4.5438296e-10 2.880366e-11 2.9183885e-10 ] [ 4.729583500000001e-10 2.3121642e-10 4.3550124e-10 ] [ 4.0075566e-10 4.0434936e-10 2.7189608e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 6.2e-06 3e-07 ] [ -9e-07 7.5e-06 -2.3e-06 ] [ 3e-06 -5.5e-06 1.2e-05 ] [ 5.8e-06 -8.2e-06 -8.8e-06 ] [ 8.4e-06 -1.02e-05 4e-06 ] [ -8.7e-06 1.9e-06 -5.8e-06 ] [ -1.6e-06 8.3e-06 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999999e-15 9.9334951308e-15 4.806529901999999e-16 ] [ -1.4419589706e-15 1.2016324755e-14 -3.685006258199999e-15 ] [ 4.806529901999999e-15 -8.811971486999999e-15 1.9226119608e-14 ] [ 9.2926244772e-15 -1.31378483988e-14 -1.40991543792e-14 ] [ 1.34582837256e-14 -1.63422016668e-14 6.408706535999999e-15 ] [ -1.39389367158e-14 3.0441356046e-15 -9.2926244772e-15 ] [ -2.5634826144e-15 1.32980660622e-14 9.613059803999998e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.049323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.052038020411878e-18 } }