{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3156347 -4.565748 -6.9312441 ] [ -2.2944759 -1.5830919 -0.6816537 ] [ 5.3196945 -0.1919034 3.1581969 ] [ -4.6221349 3.6385156 -0.0579926 ] [ 2.0558675 1.328264 -1.4314978 ] [ -1.2591119 -2.5189396 3.4392312 ] [ 3.1157954 3.8929033 2.5049601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.710055778653222e-09 -7.315134702064359e-09 -1.110507725007794e-08 ] [ -3.676155643969039e-09 -2.536392830757852e-09 -1.092129621621817e-09 ] [ 8.523090157698346e-09 -3.074631409320307e-10 5.059989237063036e-09 ] [ -7.405476474963746e-09 5.829544628736084e-09 -9.291438789940608e-11 ] [ 3.293862843962544e-09 2.128113527050291e-09 -2.293512307886635e-09 ] [ -2.017319649151068e-09 -4.035786136327304e-09 5.51025582216593e-09 ] [ 4.992054545076184e-09 6.237118654295168e-09 4.01338850825683e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.878406 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.024654073117044e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6305248 2.4556646 1.2652101 ] [ 1.0376107 2.1724216 3.0296389 ] [ 3.6079408 3.4411933 4.6632898 ] [ 1.5352854 4.2844954 3.8701155 ] [ 4.8747041 2.4690075 2.1718798 ] [ 3.2588086 1.3396025 3.5736387 ] [ 3.5289385 4.5058041 2.4315873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6305248e-10 2.4556646e-10 1.2652101e-10 ] [ 1.0376107e-10 2.1724216e-10 3.0296389e-10 ] [ 3.6079408e-10 3.4411933e-10 4.663289800000001e-10 ] [ 1.5352854e-10 4.2844954e-10 3.8701155e-10 ] [ 4.8747041e-10 2.4690075e-10 2.1718798e-10 ] [ 3.2588086e-10 1.3396025e-10 3.5736387e-10 ] [ 3.5289385e-10 4.5058041e-10 2.4315873e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 6.8e-06 1.79e-05 ] [ -2.89e-05 5.3e-06 1.6e-06 ] [ 5.09e-05 -5.56e-05 -7.62e-05 ] [ 2.71e-05 -5e-07 -1.67e-05 ] [ -3.42e-05 3.36e-05 0.0001092 ] [ 1.7e-05 2.42e-05 -2.13e-05 ] [ -3.54e-05 -1.37e-05 -1.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 1.089480102144e-14 2.867896151232001e-14 ] [ -4.630290434112001e-14 8.491536090240001e-15 2.56348259328e-15 ] [ 8.155078999872e-14 -8.908102011648e-14 -1.2208585850496e-13 ] [ 4.341898642368e-14 -8.010883104e-16 -2.675634956736e-14 ] [ -5.479444043136e-14 5.383313445888e-14 1.7495768699136e-13 ] [ 2.72370025536e-14 3.877267422336e-14 -3.412636202304e-14 ] [ -5.671705237632e-14 -2.194981970496e-14 -2.32315610016e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.786315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.490552454638435e-18 } }