{ "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" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6238252 -1.440887 -3.5114621 ] [ -6.1266886 0.2156359 9.3310917 ] [ -0.4346651 0.6691633 -0.2765676 ] [ 1.2686601 -8.8709857 -3.9536473 ] [ 7.3729959 1.4987571 3.9737295 ] [ 1.5435229 7.9283164 -5.5631444 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.806008013305884e-09 -2.30855546461465e-09 -5.625982481445271e-09 ] [ -9.816037237841882e-09 3.454867975851667e-10 1.495005696828093e-08 ] [ -6.964102610976941e-10 1.072117794757377e-09 -4.431101427907661e-10 ] [ 2.03261755196179e-09 -1.421288589199112e-08 -6.334441270949045e-09 ] [ 1.181284165623426e-08 2.401273585878008e-09 6.366616502283273e-09 ] [ 2.472996304049416e-09 1.270256317838522e-08 -8.913139895814445e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8458685 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.763937218171165e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.781662 2.027098 1.8482003 ] [ 2.6754055 3.1801549 4.9674311 ] [ 1.7412026 3.9882199 2.9840498 ] [ 3.8427383 1.2365849 2.375544 ] [ 4.6302798 2.880119 3.7232652 ] [ 3.9014908 4.6793012 2.4227676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.781662e-10 2.027098e-10 1.8482003e-10 ] [ 2.6754055e-10 3.1801549e-10 4.9674311e-10 ] [ 1.7412026e-10 3.9882199e-10 2.9840498e-10 ] [ 3.8427383e-10 1.2365849e-10 2.375544e-10 ] [ 4.630279800000001e-10 2.880119e-10 3.723265200000001e-10 ] [ 3.9014908e-10 4.679301200000001e-10 2.4227676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.86e-05 6.8e-06 -2.18e-05 ] [ 8e-07 4.7e-06 5.2e-06 ] [ -1.6e-05 -2.56e-05 1.59e-05 ] [ 9.9e-06 -1.44e-05 2.5e-06 ] [ 9.7e-06 -2.5e-06 2.21e-05 ] [ 2.42e-05 3.1e-05 -2.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.582225135488e-14 1.089480102144e-14 -3.492745033344e-14 ] [ 1.28174129664e-15 7.53023011776e-15 8.33131842816e-15 ] [ -2.56348259328e-14 -4.101572149248001e-14 2.547460827072e-14 ] [ 1.586154854592e-14 -2.307134333952e-14 4.005441552e-15 ] [ 1.554111322176e-14 -4.005441552e-15 3.540810331968e-14 ] [ 3.877267422336e-14 4.96674752448e-14 -3.797158591296e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }