{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.434862 1.342701 0.1336929 ] [ 0.0027719 -1.3991426 -0.8411683 ] [ -0.8736341 2.0833192 1.2144861 ] [ 0.8446647 1.9402127 -0.3265026 ] [ -0.6434393 -2.3805341 1.8220336 ] [ 0.2347748 -1.5865562 -2.0025417 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.96725735414508e-10 2.151244168648434e-09 2.141996405116986e-10 ] [ 4.441073411784599e-12 -2.241673581354008e-09 -1.347700195521502e-09 ] [ -1.399716141685619e-09 3.337845343403572e-09 1.945821251737787e-09 ] [ 1.35330204590462e-09 3.108563452930051e-09 -5.231148366602483e-10 ] [ -1.030903411857316e-09 -3.814036111460219e-09 2.919219660282902e-09 ] [ 3.761506988120232e-10 -2.541943272167831e-09 -3.208425520350637e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.515796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.165469254111066e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0924126 0.3484978 1.4486894 ] [ -0.0465377 2.3819051 2.599449 ] [ 2.0745683 0.4501287 0.0912112 ] [ 2.236099 0.3421376 2.4486708 ] [ 3.053793 2.5408707 0.476177 ] [ 2.2740948 2.6738355 2.678731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.24126e-12 3.484978e-11 1.4486894e-10 ] [ -4.653770000000001e-12 2.3819051e-10 2.599449e-10 ] [ 2.0745683e-10 4.501287e-11 9.12112e-12 ] [ 2.236099e-10 3.421376e-11 2.4486708e-10 ] [ 3.053793e-10 2.5408707e-10 4.76177e-11 ] [ 2.2740948e-10 2.6738355e-10 2.678731e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 1.53e-05 2.32e-05 ] [ -2.74e-05 -2.75e-05 1.1e-06 ] [ 5e-07 -1.3e-06 -9.2e-06 ] [ -2.09e-05 -1.09e-05 2.3e-06 ] [ 3.01e-05 1.17e-05 -1.95e-05 ] [ 1.28e-05 1.27e-05 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665506599998e-15 2.45133025002e-14 3.71704979088e-14 ] [ -4.389963977159999e-14 -4.4059857435e-14 1.7623942974e-15 ] [ 8.010883169999999e-16 -2.0828296242e-15 -1.47400250328e-14 ] [ -3.34854916506e-14 -1.74637253106e-14 3.685006258199999e-15 ] [ 4.82255166834e-14 1.87454666178e-14 -3.1242444363e-14 ] [ 2.05078609152e-14 2.03476432518e-14 3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.021857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.727202155268934e-18 } }