{ "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" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1981348 -3.2068189 -2.0568842 ] [ -7.029862 8.213414 0.4042917 ] [ -1.6160359 -4.5170013 2.2774812 ] [ 0.4218153 -0.647645 -0.7492708 ] [ 6.3125385 -3.8196218 -1.8658727 ] [ 2.3785587 3.3961193 -1.6202982 ] [ 1.73112 0.5815537 3.610553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.521800214942263e-09 -5.137890311049582e-09 -3.295491804083782e-09 ] [ -1.126308063664451e-08 1.315933999616848e-08 6.477467150601378e-10 ] [ -2.58917495868516e-09 -7.237033938607624e-09 3.64892716301428e-09 ] [ 6.758226175237001e-10 -1.03764168612693e-09 -1.200464168298487e-09 ] [ 1.011380168592541e-08 -6.119708798677021e-09 -2.989457641958492e-09 ] [ 3.810871171737416e-09 5.441182988736436e-09 -2.596003916152258e-09 ] [ 2.77356001465008e-09 9.317517495562457e-10 5.784743652418601e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.53445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.16845795440413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7666173 0.9680963 1.3397777 ] [ 2.002833 3.0018675 2.8482561 ] [ 2.7002347 -0.1275126 3.3035034 ] [ 2.4718952 1.762154 4.8564799 ] [ 4.9828537 0.7578874 3.1024068 ] [ 3.9822243 2.2102017 1.4655153 ] [ 4.8256849 1.7806483 5.2536018 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7666173e-10 9.680963e-11 1.3397777e-10 ] [ 2.002833e-10 3.0018675e-10 2.8482561e-10 ] [ 2.7002347e-10 -1.275126e-11 3.3035034e-10 ] [ 2.4718952e-10 1.762154e-10 4.8564799e-10 ] [ 4.9828537e-10 7.578874e-11 3.1024068e-10 ] [ 3.9822243e-10 2.2102017e-10 1.4655153e-10 ] [ 4.8256849e-10 1.7806483e-10 5.2536018e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 -1.32e-05 -2.7e-05 ] [ -1.29e-05 2.38e-05 -2.2e-06 ] [ 5.9e-06 1.6e-06 3.9e-06 ] [ -1.11e-05 4.9e-06 4.53e-05 ] [ 1.59e-05 3.8e-06 -4.8e-06 ] [ 9.2e-06 -8.3e-06 -6.9e-06 ] [ -9e-07 -1.25e-05 -8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.773277467399999e-15 -2.11487315688e-14 -4.325876911799999e-14 ] [ -2.06680785786e-14 3.81318038892e-14 -3.5247885948e-15 ] [ 9.452842140600001e-15 2.5634826144e-15 6.248488872599999e-15 ] [ -1.77841606374e-14 7.850665506599998e-15 7.25786015202e-14 ] [ 2.54746084806e-14 6.088271209199999e-15 -7.690447843199998e-15 ] [ 1.47400250328e-14 -1.32980660622e-14 -1.10550187746e-14 ] [ -1.4419589706e-15 -2.0027207925e-14 -1.34582837256e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.082717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897170665663458e-18 } }