{ "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" [ [ 1.009597 0.3628337 1.078601 ] [ 0.0352367 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.0072977 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.52367e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.2977e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.1024987 -35.8955255 -68.5978043 ] [ -53.4953081 -38.385661 25.3310457 ] [ -55.6264185 60.1163498 1.1053698 ] [ 37.0922319 -67.75052 39.0777286 ] [ 28.9455963 36.7667677 -41.7543534 ] [ 59.1863971 45.1485891 44.8380137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.57990469536024e-08 -5.751097174743023e-08 -1.099057982876737e-07 ] [ -8.570893196031287e-08 -6.150060862815435e-08 4.058480920095637e-08 ] [ -8.912334721953662e-08 9.631701017739476e-08 1.770997650898372e-09 ] [ 5.942830676347197e-08 -1.085482991910428e-07 6.260942315688752e-08 ] [ 4.637595766697498e-08 5.890685563132459e-08 -6.689784883410099e-08 ] [ 9.482706170300492e-08 7.233601391812572e-08 7.18384172732501e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 86.518815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.386184226523204e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.1866825 0.0554653 0.2513097 ] [ 0.033079 -0.1474343 2.458127 ] [ -0.1902332 2.3400215 2.3895331 ] [ 2.0023782 -0.2233426 3.8073784 ] [ 1.9332315 2.2933033 1.073961 ] [ 3.3435502 1.4993829 2.8303998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1866825e-10 5.546530000000001e-12 2.513097e-11 ] [ 3.3079e-12 -1.474343e-11 2.458127e-10 ] [ -1.902332e-11 2.3400215e-10 2.3895331e-10 ] [ 2.0023782e-10 -2.233426e-11 3.8073784e-10 ] [ 1.9332315e-10 2.2933033e-10 1.073961e-10 ] [ 3.3435502e-10 1.4993829e-10 2.8303998e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.18e-05 1.23e-05 1.28e-05 ] [ 2.15e-05 2.15e-05 -5.2e-06 ] [ 0.0 -8e-06 -2.32e-05 ] [ -8e-06 -7.2e-06 -9.1e-06 ] [ -1.28e-05 -3.18e-05 3.32e-05 ] [ 1.11e-05 1.33e-05 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.890568412544e-14 1.970677243584e-14 2.050786074624e-14 ] [ 3.44467973472e-14 3.44467973472e-14 -8.33131842816e-15 ] [ 0.0 -1.28174129664e-14 -3.717049760256e-14 ] [ -1.28174129664e-14 -1.153567166976e-14 -1.457980724928e-14 ] [ -2.050786074624e-14 -5.094921654144e-14 5.319226381056e-14 ] [ 1.778416049088e-14 2.130894905664e-14 -1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }