{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7563648 -0.9505802 -0.0515946 ] [ 6.3479789 0.2146869 0.562408 ] [ -2.0812914 3.0069544 -0.1745322 ] [ 0.7594462 -0.1402861 0.0129528 ] [ 0.188155 -7.3322428 -0.4081355 ] [ -2.5277375 0.1557597 2.1198913 ] [ 3.0698137 5.0457081 -2.0609898 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.222713179340081e-09 -1.522997385183047e-09 -8.266366256057638e-11 ] [ 1.017058346670502e-08 3.439663348058946e-10 9.01076956374672e-10 ] [ -3.334596449625147e-09 4.81767207918349e-09 -2.796314127206148e-10 ] [ 1.216766956420091e-09 -2.247631114949874e-10 2.07526735048752e-11 ] [ 3.0145754457027e-10 -1.174754808897473e-08 -6.539051616059069e-10 ] [ -4.049881959385575e-09 2.495545518588498e-10 3.396440307479884e-09 ] [ 4.918383780873085e-09 8.084115619804534e-09 -3.302069700472333e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.272261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.607103635654947e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6993967 1.0438443 2.7764006 ] [ 2.7267446 1.1275949 1.3295063 ] [ 2.0990555 3.2392064 2.7184358 ] [ 2.044887 0.086028 4.6050138 ] [ 4.0710994 0.1697315 3.1589285 ] [ 2.3627369 2.4587055 5.1889217 ] [ 4.3900837 2.5424555 3.7420234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.993967e-11 1.0438443e-10 2.7764006e-10 ] [ 2.7267446e-10 1.1275949e-10 1.3295063e-10 ] [ 2.0990555e-10 3.2392064e-10 2.7184358e-10 ] [ 2.044887e-10 8.602799999999999e-12 4.6050138e-10 ] [ 4.0710994e-10 1.697315e-11 3.1589285e-10 ] [ 2.3627369e-10 2.4587055e-10 5.1889217e-10 ] [ 4.3900837e-10 2.5424555e-10 3.7420234e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 2e-07 2.8e-05 ] [ 1.69e-05 4.1e-06 -1.12e-05 ] [ -1.6e-05 4.7e-06 -1.92e-05 ] [ -8e-07 -9.7e-06 -8.7e-06 ] [ -2.51e-05 -7.6e-06 4.6e-06 ] [ -6.1e-06 -7.1e-06 6e-07 ] [ 2.71e-05 1.53e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706535999999e-15 3.204353268e-16 4.486094575199999e-14 ] [ 2.70767851146e-14 6.568924199399999e-15 -1.79443783008e-14 ] [ -2.5634826144e-14 7.530230179799999e-15 -3.076179137279999e-14 ] [ -1.2817413072e-15 -1.55411133498e-14 -1.39389367158e-14 ] [ -4.02146335134e-14 -1.21765424184e-14 7.370012516399999e-15 ] [ -9.773277467399999e-15 -1.13754541014e-14 9.613059803999998e-16 ] [ 4.34189867814e-14 2.45133025002e-14 9.452842140600001e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.757316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.485906331375434e-18 } }