{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5859428 -5.1990224 7.6512963 ] [ -1.631161 4.6229887 -1.342796 ] [ -7.5051551 1.800271 -5.3070077 ] [ -0.093731 6.4071926 2.1588878 ] [ 7.0631504 -4.9255365 -5.6688522 ] [ 1.9429684 -1.8321442 2.1268132 ] [ 3.8098711 -0.8737493 0.3816586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.74531371768609e-09 -8.329752140295506e-09 1.225872805067354e-08 ] [ -2.613408018960749e-09 7.406844413362584e-09 -2.151396357703757e-09 ] [ -1.202458403669789e-08 2.884352107304237e-09 -8.50276366334558e-09 ] [ -1.501736168442048e-10 1.026545418868277e-08 3.458919560090347e-09 ] [ 1.131641444007417e-08 -7.891579425197058e-09 -9.082502461610647e-09 ] [ 3.112978545433183e-09 -2.935418603174319e-09 3.407530385848834e-09 ] [ 6.104086404681579e-09 -1.399900700900366e-09 6.114844860472589e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.115372 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.941096577069494e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3395626 2.9686063 3.8693841 ] [ 2.9041332 5.6180801 0.9609171 ] [ 1.0039262 3.8404539 1.5033478 ] [ 2.1030044 5.3973854 3.3745967 ] [ 3.3091329 2.9817851 0.8213733 ] [ 5.1633292 4.6277984 1.5824313 ] [ 3.8113107 3.3964238 3.3705027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3395626e-10 2.9686063e-10 3.8693841e-10 ] [ 2.9041332e-10 5.618080100000001e-10 9.609171e-11 ] [ 1.0039262e-10 3.8404539e-10 1.5033478e-10 ] [ 2.1030044e-10 5.3973854e-10 3.3745967e-10 ] [ 3.3091329e-10 2.9817851e-10 8.213733e-11 ] [ 5.1633292e-10 4.6277984e-10 1.5824313e-10 ] [ 3.8113107e-10 3.3964238e-10 3.3705027e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.52e-05 2.25e-05 5.2e-06 ] [ 1.8e-05 2.46e-05 -1.06e-05 ] [ -3.1e-06 -8.1e-06 6.5e-06 ] [ -1.63e-05 -4.44e-05 -6.9e-06 ] [ -2.6e-06 1.36e-05 9.4e-06 ] [ -6e-07 -1.37e-05 -2.1e-06 ] [ -2.06e-05 5.6e-06 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.037485084416e-14 3.604897396800001e-14 8.33131842816e-15 ] [ 2.88391791744e-14 3.941354487168e-14 -1.698307218048e-14 ] [ -4.96674752448e-15 -1.297763062848e-14 1.04141480352e-14 ] [ -2.611547891904e-14 -7.113664196352e-14 -1.105501868352e-14 ] [ -4.16565921408e-15 2.178960204288e-14 1.506046023552e-14 ] [ -9.6130597248e-16 -2.194981970496e-14 -3.36457090368e-15 ] [ -3.300483838848e-14 8.972189076479999e-15 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.515581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.646087775712869e-18 } }