{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.01234e-12 9.337250000000001e-12 1.2072713e-10 ] [ 4.21386e-12 1.6813433e-10 2.9418657e-10 ] [ 1.8258201e-10 5.582598e-11 -2.2616e-11 ] [ 2.9381087e-10 2.4588335e-10 5.997076999999999e-11 ] [ 1.8130381e-10 3.1750657e-10 2.5367909e-10 ] ] "source-value" [ [ 0.0201234 0.0933725 1.2072713 ] [ 0.0421386 1.6813433 2.9418657 ] [ 1.8258201 0.5582598 -0.22616 ] [ 2.9381087 2.4588335 0.5997077 ] [ 1.8130381 3.1750657 2.5367909 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.7848247555712e-12 -2.21052308371776e-12 1.5637243819008e-13 ] [ -1.76127275924544e-12 3.21044151275904e-12 -7.738513078464e-13 ] [ -7.265870975328e-13 9.2429569253952e-13 6.3157802391936e-13 ] [ -8.010883104e-15 6.6506351529408e-13 -1.92116998600128e-12 ] [ 7.112062019731201e-13 -2.58943785453696e-12 1.90707083173824e-12 ] ] "source-value" [ [ 0.001114 -0.0013797 9.76e-05 ] [ -0.0010993 0.0020038 -0.000483 ] [ -0.0004535 0.0005769 0.0003942 ] [ -5e-06 0.0004151 -0.0011991 ] [ 0.0004439 -0.0016162 0.0011903 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.853844121130333e-18 "source-value" -11.570785 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.501629659321199e-08 -2.829391072547846e-08 -2.019682154709035e-08 ] [ -7.227559888189093e-09 2.775223051131687e-10 5.054356496760822e-08 ] [ -1.826342310824847e-08 -7.357932508590387e-08 -6.547017392082607e-08 ] [ 1.519831630248173e-07 5.283167794028275e-09 -3.091021163454573e-08 ] [ -8.147588343516774e-08 9.631254571224092e-08 6.603364213485394e-08 ] ] "source-value" [ [ -28.0969626 -17.6596702 -12.6058646 ] [ -4.5110881 0.1732158 31.5468122 ] [ -11.3991322 -45.9246029 -40.8632688 ] [ 94.8604299 3.297494 -19.2926368 ] [ -50.853247 60.1135633 41.214958 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.679791723303781e-18 "source-value" 41.691981 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] "source-value" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] } "instance-id" 1 }