{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6899766 -2.8202646 -2.5811978 ] [ -8.3865283 -2.7224805 3.1133142 ] [ 0.1797976 -0.0846262 -0.8286113 ] [ -3.0293602 9.178433 6.2735992 ] [ 22.8089767 2.5227433 -11.4934442 ] [ -0.8829092 -6.0738049 5.5163399 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.712723058541907e-08 -4.518562006589863e-09 -4.135534768820394e-09 ] [ -1.343669957193757e-08 -4.361894607683894e-09 4.988079224444656e-09 ] [ 2.880675111959501e-10 -1.35586119147145e-10 -1.327581652590695e-09 ] [ -4.853570088422012e-09 1.470547076817921e-08 1.005141396650958e-08 ] [ 3.654400921311194e-08 4.041880335539841e-09 -1.841452758970936e-08 ] [ -1.414576478529231e-09 -9.731308210080481e-09 8.838150820166211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2003995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.474066498092001e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4846541 0.7708361 -0.0126425 ] [ 0.6528735 3.1336788 0.8379585 ] [ 0.1171075 1.8928128 2.9611733 ] [ 1.9037646 0.384411 2.0298209 ] [ 2.7791513 1.9119637 0.2114739 ] [ 2.4908379 2.7920796 2.5442178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.846541e-11 7.708361000000001e-11 -1.26425e-12 ] [ 6.528735e-11 3.1336788e-10 8.379585e-11 ] [ 1.171075e-11 1.8928128e-10 2.9611733e-10 ] [ 1.9037646e-10 3.84411e-11 2.0298209e-10 ] [ 2.7791513e-10 1.9119637e-10 2.114739e-11 ] [ 2.4908379e-10 2.7920796e-10 2.5442178e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.79e-05 4.88e-05 4.34e-05 ] [ 7.69e-05 -6.34e-05 4.5e-06 ] [ 7.89e-05 2.59e-05 -6e-07 ] [ -3.14e-05 4.15e-05 -1.24e-05 ] [ -9.52e-05 1.48e-05 6.7e-06 ] [ -0.0001171 -6.76e-05 -4.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.4083132496832e-13 7.818621909504e-14 6.953446534272e-14 ] [ 1.2320738213952e-13 -1.0157799775872e-13 7.2097947936e-15 ] [ 1.2641173538112e-13 4.149637447872e-14 -9.6130597248e-16 ] [ -5.030834589312e-14 6.64903297632e-14 -1.986699009792e-14 ] [ -1.5252721430016e-13 2.371221398784e-14 1.073458335936e-14 ] [ -1.8761488229568e-13 -1.0830713956608e-13 -6.665054742528e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.071805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536292994985655e-18 } }