{ "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" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.3111117 -0.3255499 -1.495687 ] [ -1.0478186 1.2295712 -0.5873122 ] [ 16.2379295 -33.3142937 -17.5198711 ] [ -1.8498716 -4.5228848 2.9879727 ] [ -11.1492061 16.9314637 -24.848784 ] [ 13.1200784 20.0016934 41.4636816 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.453110520419735e-08 -5.215884386837779e-10 -2.39635474343449e-09 ] [ -1.678790463759387e-09 1.969990230249001e-09 -9.409778759506137e-10 ] [ 2.601603101509863e-08 -5.337538250460473e-08 -2.806992787584958e-08 ] [ -2.963821029001889e-09 -7.246460285131684e-09 4.787260003528653e-09 ] [ -1.786299735390075e-08 2.712719529606386e-08 -3.98121407801091e-08 ] [ 2.102068287554307e-08 3.204624554188966e-08 6.643214127181514e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.055467120918063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.572369405715801e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3934822 2.6970231 0.5217731 ] [ 0.9291361 1.713032 2.2320017 ] [ 3.1970732 1.1000434 1.0458103 ] [ 1.7698844 -0.4979109 2.0144742 ] [ 1.9092986 3.001864 0.1572408 ] [ 2.9245615 3.0973102 2.3028306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.934822e-11 2.6970231e-10 5.217731e-11 ] [ 9.291361000000001e-11 1.713032e-10 2.2320017e-10 ] [ 3.1970732e-10 1.1000434e-10 1.0458103e-10 ] [ 1.7698844e-10 -4.979109e-11 2.0144742e-10 ] [ 1.9092986e-10 3.001864e-10 1.572408e-11 ] [ 2.9245615e-10 3.0973102e-10 2.3028306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.17e-05 -3e-07 -5.9e-06 ] [ 4.5e-06 1.15e-05 -6.8e-06 ] [ -1.2e-06 1.2e-06 2.2e-06 ] [ 1.06e-05 1.52e-05 -1.4e-06 ] [ 1.3e-05 -8.4e-06 8.9e-06 ] [ 4.8e-06 -1.92e-05 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.078899887936e-14 -4.8065298624e-16 -9.45284206272e-15 ] [ 7.2097947936e-15 1.84250311392e-14 -1.089480102144e-14 ] [ -1.92261194496e-15 1.92261194496e-15 3.52478856576e-15 ] [ 1.698307218048e-14 2.435308463616e-14 -2.24304726912e-15 ] [ 2.08282960704e-14 -1.345828361472e-14 1.425937192512e-14 ] [ 7.69044777984e-15 -3.076179111936e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.246758279081938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.000841007053392e-18 } }