{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.8501817 -9.6540423 -1.6603208 ] [ -11.0198745 5.1125177 -6.2030917 ] [ -1.7922338 -2.4472397 10.0988893 ] [ -1.1473725 7.3084836 1.9362479 ] [ 6.954506 -1.6291864 -0.427587 ] [ 1.6210694 2.1050801 -5.2961639 ] [ -0.4662763 -0.795613 1.5520261 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.373024347172e-09 -1.546748086927426e-08 -2.660127168787953e-09 ] [ -1.765578528805009e-08 8.191156332366188e-09 -9.938448498418528e-09 ] [ -2.871475093367543e-09 -3.920910232833605e-09 1.618020433250728e-08 ] [ -1.838293394848848e-09 1.170948155742022e-08 3.102211117453096e-09 ] [ 1.114234692241333e-08 -2.610244361005317e-09 -6.850698947580096e-10 ] [ 2.597239493374284e-09 3.372710121131326e-09 -8.48538998050495e-09 ] [ -7.470569866931271e-10 -1.27471254780455e-09 2.486619932291403e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.412247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.668225871339494e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.5425684 0.6756938 2.5971185 ] [ 1.2100779 3.5270634 2.1384951 ] [ 1.9707478 2.0037728 3.8252598 ] [ 2.7791675 5.3673777 3.1117497 ] [ 4.8895057 2.6413228 2.3425618 ] [ 3.4718469 4.0210975 0.9895345 ] [ 3.7918087 3.557967 4.3271173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5425684e-10 6.756938000000001e-11 2.5971185e-10 ] [ 1.2100779e-10 3.5270634e-10 2.1384951e-10 ] [ 1.9707478e-10 2.0037728e-10 3.8252598e-10 ] [ 2.7791675e-10 5.367377699999999e-10 3.1117497e-10 ] [ 4.8895057e-10 2.6413228e-10 2.3425618e-10 ] [ 3.4718469e-10 4.0210975e-10 9.895345e-11 ] [ 3.7918087e-10 3.557967e-10 4.327117300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.54e-05 5.19e-05 -5.5e-06 ] [ 2.18e-05 -1.41e-05 -2.32e-05 ] [ 3.16e-05 7e-06 1.68e-05 ] [ 1.02e-05 -2.67e-05 -3.4e-06 ] [ -2.18e-05 1.42e-05 1.72e-05 ] [ -1.29e-05 -7.4e-06 -4.2e-06 ] [ -3.5e-06 -2.49e-05 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.069528616832e-14 8.315296661952001e-14 -8.8119714144e-15 ] [ 3.492745033344e-14 -2.259069035328e-14 -3.717049760256e-14 ] [ 5.062878121728e-14 1.12152363456e-14 2.691656722944e-14 ] [ 1.634220153216e-14 -4.277811577536e-14 -5.44740051072e-15 ] [ -3.492745033344e-14 2.275090801536e-14 2.755743787776e-14 ] [ -2.066807840832e-14 -1.185610699392e-14 -6.72914180736e-15 ] [ -5.6076181728e-15 -3.989419785791999e-14 3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }