{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2109287 2.0410278 -1.907756 ] [ -3.5363644 -2.0636791 5.0864118 ] [ -4.1514832 -3.2104612 -0.708926 ] [ 1.9231376 -1.3545505 -4.6129614 ] [ 8.1288629 -4.7228909 -0.4958723 ] [ 0.7168667 7.2146899 4.6814236 ] [ 2.1299091 2.095864 -2.0423197 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.348828135795737e-09 3.270087023562858e-09 -3.056562061390925e-09 ] [ -5.66588036430942e-09 -3.306378406853585e-09 8.149330069721246e-09 ] [ -6.651409324683971e-09 -5.143725876625513e-09 -1.135824663077261e-09 ] [ 3.081206101301422e-09 -2.170229142792951e-09 -7.390778907732837e-09 ] [ 1.302387409206849e-08 -7.566905382569072e-09 -7.944750059623238e-10 ] [ 1.148547066970047e-09 1.155920748410189e-08 7.500467443981371e-09 ] [ 3.412490564449169e-09 3.357944301176372e-09 -3.27215687553927e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.842633 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538269620451457e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7003839 2.9753724 3.0479401 ] [ 2.8077128 0.6287057 5.223832 ] [ 1.6627811 0.5454547 3.0815827 ] [ 3.8384926 0.5680267 1.9986178 ] [ 4.9937674 1.1634435 4.134541 ] [ 3.3049121 3.065171 4.9633596 ] [ 4.119057 3.0172283 2.4157197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7003839e-10 2.9753724e-10 3.0479401e-10 ] [ 2.8077128e-10 6.287057e-11 5.223832e-10 ] [ 1.6627811e-10 5.454547e-11 3.0815827e-10 ] [ 3.8384926e-10 5.680267e-11 1.9986178e-10 ] [ 4.9937674e-10 1.1634435e-10 4.134541e-10 ] [ 3.3049121e-10 3.065171e-10 4.963359600000001e-10 ] [ 4.119057e-10 3.0172283e-10 2.4157197e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.37e-05 -2.07e-05 -1.06e-05 ] [ 2.4e-05 2.06e-05 -2.92e-05 ] [ 1.19e-05 4.43e-05 9.6e-06 ] [ -7.1e-06 -5.4e-06 6.23e-05 ] [ -2.75e-05 2.19e-05 -4.74e-05 ] [ -3.06e-05 -5.23e-05 -1.48e-05 ] [ -3.44e-05 -8.4e-06 3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.0205865074496e-13 -3.316505605055999e-14 -1.698307218048e-14 ] [ 3.84522388992e-14 3.300483838848e-14 -4.678355732736e-14 ] [ 1.906590178752e-14 7.097642430144e-14 1.538089555968e-14 ] [ -1.137545400768e-14 -8.65175375232e-15 9.981560347584e-14 ] [ -4.4059857072e-14 3.508766799552e-14 -7.594317182591999e-14 ] [ -4.902660459647999e-14 -8.379383726784e-14 -2.371221398784e-14 ] [ -5.511487575552001e-14 -1.345828361472e-14 4.8065298624e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }