{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6136317 0.272403 0.5113261 ] [ 1.058649 2.716721 0.3297698 ] [ 0.0311528 1.744123 2.343307 ] [ 2.175185 1.227279 1.696033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.136317e-11 2.72403e-11 5.113261e-11 ] [ 1.058649e-10 2.716721e-10 3.297698e-11 ] [ 3.11528e-12 1.744123e-10 2.343307e-10 ] [ 2.175185e-10 1.227279e-10 1.696033e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8442149 -7.602433 -4.7919726 ] [ 0.2387483 7.2265332 -5.1560099 ] [ -5.9051154 1.7646513 6.5384517 ] [ 8.510582 -1.3887514 3.4095307 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.55693461731101e-09 -1.218044041379841e-08 -7.677586467234191e-09 ] [ 3.825169445157446e-10 1.157818254247501e-08 -8.260838518393345e-09 ] [ -9.461037837006039e-09 2.827283056724327e-09 1.047575444997002e-08 ] [ 1.36354555098013e-08 -2.225025025183269e-09 5.462670375439858e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.003713572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.949798238057498e-22 } "relaxed-configuration-positions" { "source-value" [ [ 0.6372357 -0.15951 1.3333298 ] [ 1.3020743 3.1397731 1.1068916 ] [ -0.6394982 1.8394449 1.5851452 ] [ 2.5788068 1.140818 0.8550692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.372357e-11 -1.5951e-11 1.3333298e-10 ] [ 1.3020743e-10 3.1397731e-10 1.1068916e-10 ] [ -6.394982000000001e-11 1.8394449e-10 1.5851452e-10 ] [ 2.5788068e-10 1.140818e-10 8.550692e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 -5e-06 -2e-06 ] [ -1.1e-06 4.5e-06 -1.6e-06 ] [ 7.6e-06 8e-07 0.0 ] [ -7.8e-06 -3e-07 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 -8.010883104e-15 -3.2043532416e-15 ] [ -1.76239428288e-15 7.2097947936e-15 -2.56348259328e-15 ] [ 1.217654231808e-14 1.28174129664e-15 0.0 ] [ -1.249697764224e-14 -4.8065298624e-16 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.5109562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.82952518189281e-19 } }