{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 257.9400758 -61.3737476 135.3636935 ] [ 169.5932576 -326.0901723 142.7012448 ] [ 14.698041 389.4771128 -115.8414402 ] [ -580.6743845 -822.5517501 -1096.3436816 ] [ 232.5612225 867.5997226 924.8369536 ] [ -94.1182123 -47.0611654 9.2832298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.132655590141398e-07 -9.833158353560011e-08 2.168765450308369e-07 ] [ 2.717183523720319e-07 -5.224540503317038e-07 2.286325981776176e-07 ] [ 2.354885766175985e-08 6.240111244648444e-07 -1.855984472082413e-07 ] [ -9.303429231433299e-07 -1.317873183408344e-06 -1.756536215021319e-06 ] [ 3.726041535941669e-07 1.390047991762285e-06 1.481752145109815e-06 ] [ -1.50793999338551e-07 -7.540029895148189e-08 1.487337375107386e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 393.93041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.311460931241586e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.0929856 0.5972596 0.2702488 ] [ 0.6211733 0.4148753 3.3224471 ] [ -0.2059807 2.8270781 2.0413624 ] [ 2.3882247 -0.6297122 0.9464071 ] [ 3.3868593 1.0504019 3.0204487 ] [ 2.4754103 3.5733723 2.2496848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.29856e-12 5.972596e-11 2.702488e-11 ] [ 6.211733000000001e-11 4.148753e-11 3.3224471e-10 ] [ -2.059807e-11 2.8270781e-10 2.0413624e-10 ] [ 2.3882247e-10 -6.297122000000001e-11 9.464070999999999e-11 ] [ 3.3868593e-10 1.0504019e-10 3.020448700000001e-10 ] [ 2.4754103e-10 3.5733723e-10 2.2496848e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 -2.19e-05 -5.6e-06 ] [ 2.78e-05 5.6e-06 -1.9e-05 ] [ 1.1e-05 3.79e-05 1.72e-05 ] [ -5e-06 -1.31e-05 -1.02e-05 ] [ -4e-06 -1.83e-05 2.47e-05 ] [ -3.19e-05 9.8e-06 -7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 -3.508766799552e-14 -8.972189076479999e-15 ] [ 4.454051005824e-14 8.972189076479999e-15 -3.04413557952e-14 ] [ 1.76239428288e-14 6.072249392832e-14 2.755743787776e-14 ] [ -8.010883104e-15 -2.098851373248e-14 -1.634220153216e-14 ] [ -6.4087064832e-15 -2.931983216064e-14 3.957376253376001e-14 ] [ -5.110943420352001e-14 1.570133088384e-14 -1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.539142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.489645001969136e-18 } }