{ "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" [ [ 2.1287444 -1.4778908 0.7513165 ] [ -2.8019661 -2.4204444 -1.5075331 ] [ -4.8605789 1.5676595 2.9799609 ] [ 0.0634628 0.8015007 0.2399213 ] [ -1.1375196 0.2691227 -1.4935446 ] [ 5.5929015 -1.6890985 2.0714873 ] [ 1.0149559 2.9491508 -3.0416082 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.410624509338924e-09 -2.367842087855408e-09 1.203741731121283e-09 ] [ -4.489244577694155e-09 -3.877979429626284e-09 -2.415334287902149e-09 ] [ -7.787505877133783e-09 2.511667400275018e-09 4.774423684878127e-09 ] [ 1.016786144505062e-10 1.284145683094835e-09 3.843962976919431e-10 ] [ -1.822507308821768e-09 4.311820980665722e-10 -2.392922240242088e-09 ] [ 8.960816025737251e-09 -2.706234126928349e-09 3.318888522344116e-09 ] [ 1.626138614123023e-09 4.725060462973617e-09 -4.873193547673571e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.201392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.076402134921615e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9455991 1.1810734 2.1231172 ] [ 1.4508656 0.2589807 4.1759586 ] [ 2.4116127 2.1089547 5.1576491 ] [ 1.8821327 3.320889 3.1734839 ] [ 4.251415 1.3679233 2.1121704 ] [ 4.6073621 2.0766305 4.4300063 ] [ 4.1054979 3.7415071 2.7034065 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9455991e-10 1.1810734e-10 2.1231172e-10 ] [ 1.4508656e-10 2.589807e-11 4.175958600000001e-10 ] [ 2.4116127e-10 2.1089547e-10 5.1576491e-10 ] [ 1.8821327e-10 3.320889000000001e-10 3.1734839e-10 ] [ 4.251415e-10 1.3679233e-10 2.1121704e-10 ] [ 4.6073621e-10 2.0766305e-10 4.4300063e-10 ] [ 4.1054979e-10 3.741507100000001e-10 2.7034065e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.23e-05 3.99e-05 6.2e-06 ] [ 2.92e-05 -1.4e-05 -3.68e-05 ] [ 3.35e-05 1.79e-05 5.59e-05 ] [ -5e-06 -2.18e-05 -5.74e-05 ] [ -1.71e-05 -3.49e-05 5.6e-06 ] [ -1.26e-05 1.1e-06 1.17e-05 ] [ -5.6e-06 1.17e-05 1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.572853864384e-14 6.392684716992e-14 9.93349504896e-15 ] [ 4.678355732736e-14 -2.24304726912e-14 -5.896009964544001e-14 ] [ 5.36729167968e-14 2.867896151232001e-14 8.956167310272e-14 ] [ -8.010883104e-15 -3.492745033344e-14 -9.196493803392e-14 ] [ -2.739722021568e-14 -5.591596406592e-14 8.972189076479999e-15 ] [ -2.018742542208e-14 1.76239428288e-15 1.874546646336e-14 ] [ -8.972189076479999e-15 1.874546646336e-14 2.387243164992e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }