{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5144937 -1.4434573 -1.2934991 ] [ -1.2889557 1.0959475 -0.738815 ] [ 0.1733899 0.2939402 1.5969238 ] [ -0.5790634 0.025428 0.6529055 ] [ 2.0042418 0.0006488 0.2870114 ] [ 0.5795274 0.9530689 0.8357124 ] [ -0.3746463 -0.925576 -1.3402389 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.243097776888891e-10 -2.312673539183092e-09 -2.072414017045841e-09 ] [ -2.065134687786899e-09 1.755901462124208e-09 -1.183712120096352e-09 ] [ 2.778012440628499e-10 4.709441163532761e-10 2.558553977559095e-09 ] [ -9.277618414409587e-10 4.07401471137024e-11 1.046069927691734e-09 ] [ 3.211149354390109e-09 1.03949219157504e-12 4.598429549830771e-10 ] [ 9.2850525139301e-10 1.526984709591573e-09 1.338958868992658e-09 ] [ -6.00249542929223e-10 -1.482936227973581e-09 -2.147299431866709e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.982059085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.278866845274842e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4889258 2.3384452 1.603699 ] [ 1.3162017 2.1352892 3.6325264 ] [ 2.1719313 4.2519365 2.9343947 ] [ 4.6578427 1.4848502 1.6741877 ] [ 3.4663455 1.1818534 3.6556813 ] [ 4.3804211 3.4428429 2.9099467 ] [ 3.0869568 3.1691725 4.8553872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4889258e-10 2.3384452e-10 1.603699e-10 ] [ 1.3162017e-10 2.1352892e-10 3.6325264e-10 ] [ 2.1719313e-10 4.2519365e-10 2.9343947e-10 ] [ 4.6578427e-10 1.4848502e-10 1.6741877e-10 ] [ 3.4663455e-10 1.1818534e-10 3.6556813e-10 ] [ 4.380421100000001e-10 3.4428429e-10 2.9099467e-10 ] [ 3.0869568e-10 3.1691725e-10 4.8553872e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.16e-05 2.42e-05 4.58e-05 ] [ 5.09e-05 -8.6e-06 -1.58e-05 ] [ -2.29e-05 1.06e-05 -1.83e-05 ] [ 2.34e-05 -6.5e-06 -2e-05 ] [ -2.68e-05 1.42e-05 7e-06 ] [ -1.12e-05 -3.35e-05 7.9e-06 ] [ -1.8e-06 -3e-07 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.858524880128e-14 3.877267422336e-14 7.337968923264e-14 ] [ 8.155078999872e-14 -1.377871893888e-14 -2.531439060864e-14 ] [ -3.668984461632e-14 1.698307218048e-14 -2.931983216064e-14 ] [ 3.749093292672001e-14 -1.04141480352e-14 -3.2043532416e-14 ] [ -4.293833343744e-14 2.275090801536e-14 1.12152363456e-14 ] [ -1.794437815296e-14 -5.36729167968e-14 1.265719530432e-14 ] [ -2.88391791744e-15 -4.8065298624e-16 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }