{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9577148 -6.5326561 -12.0749058 ] [ -11.3915663 -5.9964833 9.1629402 ] [ -10.6302523 16.7481553 -5.3170031 ] [ 6.7210481 -2.2135954 -4.0641022 ] [ 10.6378615 -16.5911662 7.9486639 ] [ 6.3053916 8.2765743 -4.5573609 ] [ 7.3152323 6.3091715 8.9017678 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.435184122835415e-08 -1.046646887514651e-08 -1.934613177112232e-08 ] [ -1.825130120015316e-08 -9.607425350277632e-09 1.468064856622848e-08 ] [ -1.703154170826543e-08 2.683350286318761e-08 -8.518778059541124e-09 ] [ 1.076830613309226e-08 -3.546570797790424e-09 -6.511409529381846e-09 ] [ 1.704373299060842e-08 -2.658197859744718e-08 1.273516346717695e-08 ] [ 1.010235100650871e-08 1.326053384377413e-08 -7.301697086528046e-09 ] [ 1.172029416678101e-08 1.010840707391767e-08 1.426220425295025e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6964349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.320164956289186e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1113365 2.1877542 1.4282549 ] [ 1.8042302 2.3454855 4.0122116 ] [ 1.9683672 4.5084941 2.6071391 ] [ 4.4609123 2.3256799 1.915053 ] [ 4.1427239 1.9092914 4.3044019 ] [ 4.3545462 4.7006204 2.4912108 ] [ 4.9912527 4.1106385 4.7248766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1113365e-10 2.1877542e-10 1.4282549e-10 ] [ 1.8042302e-10 2.3454855e-10 4.0122116e-10 ] [ 1.9683672e-10 4.5084941e-10 2.6071391e-10 ] [ 4.460912300000001e-10 2.3256799e-10 1.915053e-10 ] [ 4.1427239e-10 1.9092914e-10 4.3044019e-10 ] [ 4.3545462e-10 4.7006204e-10 2.4912108e-10 ] [ 4.9912527e-10 4.110638500000001e-10 4.7248766e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 5.1e-06 -1.28e-05 ] [ -3.53e-05 -1.42e-05 -3.5e-06 ] [ 1.32e-05 -1.72e-05 9.8e-06 ] [ -9.3e-06 -1.38e-05 -1.91e-05 ] [ 1.41e-05 2.87e-05 2e-06 ] [ 8.1e-06 -6.6e-06 1.15e-05 ] [ 1.53e-05 1.8e-05 1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.77327738688e-15 8.17110076608e-15 -2.050786074624e-14 ] [ -5.655683471424e-14 -2.275090801536e-14 -5.6076181728e-15 ] [ 2.114873139456e-14 -2.755743787776e-14 1.570133088384e-14 ] [ -1.490024257344e-14 -2.211003736704e-14 -3.060157345728e-14 ] [ 2.259069035328e-14 4.598246901696e-14 3.2043532416e-15 ] [ 1.297763062848e-14 -1.057436569728e-14 1.84250311392e-14 ] [ 2.451330229824e-14 2.88391791744e-14 1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }