{ "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" [ [ 0.2973138 0.0992835 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.973138000000001e-11 9.92835e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.688404 -3.8314379 4.0269524 ] [ -0.239595 0.9187105 0.0759552 ] [ -12.7135707 -0.2088528 1.7317607 ] [ 10.2932728 0.3781446 -5.8201892 ] [ 4.2248218 -5.0371047 2.1078305 ] [ 10.1234752 7.7805402 -2.1223097 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.87268876232652e-08 -6.138640227427048e-09 6.45188898835445e-09 ] [ -3.83873507460576e-10 1.471936484383478e-09 1.216936456681881e-10 ] [ -2.036938574242789e-08 -3.346190733486182e-10 2.774586506360242e-09 ] [ 1.649164103167656e-08 6.058544374017676e-10 -9.324971064872657e-09 ] [ 6.768910715006174e-09 -8.070331386861798e-09 3.377116747709174e-09 ] [ 1.62195952866886e-08 1.246579960563456e-08 -3.400314983437062e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3329258 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.544289037221137e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0043308 0.1177572 2.1743486 ] [ 1.2871897 2.4744805 0.3397903 ] [ -0.0318014 2.4927222 2.3680912 ] [ 1.7664692 0.2458284 0.6952373 ] [ 3.4285822 0.8535998 2.1708041 ] [ 2.4862496 3.0338298 2.3654886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.3308e-13 1.177572e-11 2.1743486e-10 ] [ 1.2871897e-10 2.4744805e-10 3.397903e-11 ] [ -3.18014e-12 2.4927222e-10 2.3680912e-10 ] [ 1.7664692e-10 2.458284e-11 6.952372999999999e-11 ] [ 3.4285822e-10 8.535998e-11 2.1708041e-10 ] [ 2.4862496e-10 3.0338298e-10 2.3654886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.35e-05 8.6e-06 -1.1e-06 ] [ -1.7e-06 -3.09e-05 -8.5e-06 ] [ -8.1e-06 -2.3e-06 4.4e-06 ] [ -6.1e-06 3e-05 -6.7e-06 ] [ -4.8e-06 -6.9e-06 5.5e-06 ] [ 7.2e-06 1.5e-06 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.16293843808e-14 1.377871893888e-14 -1.76239428288e-15 ] [ -2.72370025536e-15 -4.950725758272e-14 -1.36185012768e-14 ] [ -1.297763062848e-14 -3.68500622784e-15 7.04957713152e-15 ] [ -9.77327738688e-15 4.8065298624e-14 -1.073458335936e-14 ] [ -7.69044777984e-15 -1.105501868352e-14 8.8119714144e-15 ] [ 1.153567166976e-14 2.4032649312e-15 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }