{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.921897 0.5298475 2.334561 ] [ 1.139586 1.500474 0.8908209 ] [ 1.083292 2.793611 2.25214 ] [ 2.326161 0.1583663 0.1821838 ] [ 2.280192 0.7456581 2.776174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.21897e-11 5.298475e-11 2.334561e-10 ] [ 1.139586e-10 1.500474e-10 8.908209000000001e-11 ] [ 1.083292e-10 2.793611e-10 2.25214e-10 ] [ 2.326161e-10 1.583663e-11 1.821838e-11 ] [ 2.280192e-10 7.456581e-11 2.776174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -55.7859359 -27.6802302 7.497349 ] [ -10.0376986 13.4920866 -33.0189131 ] [ -2.647067 24.3576272 8.6121886 ] [ 10.952674 -9.702659 -13.7833204 ] [ 57.5180275 -0.4668247 30.6926959 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.93789222684274e-08 -4.434861768480211e-08 1.201207728577826e-08 ] [ -1.608216602355689e-08 2.161670571632896e-08 -5.290213061304685e-08 ] [ -4.241068861091194e-09 3.902522083800217e-08 1.379824722884028e-08 ] [ 1.754811821804402e-08 -1.554537340939471e-08 -2.20833137018757e-08 ] [ 9.215403893503148e-08 -7.479356203519737e-10 4.917511980030402e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.505728 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.406903433968395e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2283627 0.0411775 2.4368622 ] [ 0.5182765 1.5574101 0.4743031 ] [ 1.6684479 2.9492386 2.1989971 ] [ 2.7538668 0.4463583 0.4256681 ] [ 2.5821741 0.7337724 2.9000491 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.283627e-11 4.11775e-12 2.4368622e-10 ] [ 5.182765e-11 1.5574101e-10 4.743031e-11 ] [ 1.6684479e-10 2.9492386e-10 2.1989971e-10 ] [ 2.7538668e-10 4.463583e-11 4.256681e-11 ] [ 2.5821741e-10 7.337724e-11 2.9000491e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.61e-05 8.9e-06 -2.8e-06 ] [ 1.44e-05 -7e-06 -0.0 ] [ 2.6e-06 -1.91e-05 7e-07 ] [ -2.05e-05 9.6e-06 3.6e-06 ] [ -1.26e-05 7.5e-06 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.579504359488e-14 1.425937192512e-14 -4.48609453824e-15 ] [ 2.307134333952e-14 -1.12152363456e-14 0.0 ] [ 4.16565921408e-15 -3.060157345728e-14 1.12152363456e-15 ] [ -3.28446207264e-14 1.538089555968e-14 5.76783583488e-15 ] [ -2.018742542208e-14 1.2016324656e-14 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }