{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 20.6536148 16.1913392 -65.4384714 ] [ -20.7395552 -24.343619 57.4627219 ] [ -14.5581498 0.1853881 -62.086467 ] [ 77.7403645 -19.8496627 47.1017764 ] [ -63.0962742 27.8165544 22.9604401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.309073904019658e-08 2.594138533940825e-08 -1.048439898417573e-07 ] [ -3.32284307409932e-08 -3.900277754879844e-08 9.206543035422007e-08 ] [ -2.332472744383177e-08 2.970244820416554e-10 -9.947348671501207e-08 ] [ 1.245537955205431e-07 -3.180266577072135e-08 7.546536556797263e-08 ] [ -1.01091376215697e-07 4.456703349806989e-08 3.678668063457662e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 43.173713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.917191417162204e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5583074 1.1790274 0.9744468 ] [ 0.5675769 0.313323 2.6848176 ] [ 2.7367699 1.7912262 0.2715593 ] [ 3.130538 2.9421432 2.3083843 ] [ 1.3599568 2.6375388 3.1019009 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.583074e-11 1.1790274e-10 9.744468e-11 ] [ 5.675769000000001e-11 3.133230000000001e-11 2.6848176e-10 ] [ 2.7367699e-10 1.7912262e-10 2.715593e-11 ] [ 3.130538e-10 2.9421432e-10 2.3083843e-10 ] [ 1.3599568e-10 2.6375388e-10 3.1019009e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.83e-05 -8.08e-05 0.0001343 ] [ -1.61e-05 -9.4e-06 -0.0001665 ] [ 6.04e-05 -5.92e-05 -8e-05 ] [ 3.13e-05 8.39e-05 5.98e-05 ] [ 2.26e-05 6.55e-05 5.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.574939631222e-13 -1.294558720272e-13 2.151723219462e-13 ] [ -2.579504380739999e-14 -1.50604603596e-14 -2.66762409561e-13 ] [ 9.677146869359998e-14 -9.48488567328e-14 -1.2817413072e-13 ] [ 5.014812864419999e-14 1.344226195926e-13 9.581016271319999e-14 ] [ 3.62091919284e-14 1.04942569527e-13 8.395405562159998e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.934396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.751883377810306e-18 } }