{ "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" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2021739 -1.5225719 -0.9431875 ] [ 2.0920829 1.5785639 0.7249799 ] [ -2.4999778 -1.3365462 0.4152596 ] [ -0.327507 -3.7058525 -1.1235834 ] [ 1.6728433 1.8230442 -1.3496234 ] [ 0.2647325 3.1633625 2.2761547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.926094916715957e-09 -2.439429101667036e-09 -1.5111529615308e-09 ] [ 3.351886311155464e-09 2.529138175018869e-09 1.161545846329922e-09 ] [ -4.005405983679018e-09 -2.141383074259081e-09 6.653192226827597e-10 ] [ -5.247240585483456e-10 -5.937430235633232e-09 -1.800179054998975e-09 ] [ 2.680190425521921e-09 2.92083879592504e-09 -2.162335058364607e-09 ] [ 4.24148222265936e-10 5.06826544061544e-09 3.646801845664038e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.063848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.413494508488484e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1047264 1.9987428 5.2064772 ] [ 1.4826855 1.8874147 3.4364394 ] [ 1.5891048 4.2460046 3.1905667 ] [ 3.8267959 1.7288612 2.9300277 ] [ 3.9332176 4.0874515 2.6841658 ] [ 3.2111375 4.3573341 4.9606131 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1047264e-10 1.9987428e-10 5.2064772e-10 ] [ 1.4826855e-10 1.8874147e-10 3.4364394e-10 ] [ 1.5891048e-10 4.2460046e-10 3.1905667e-10 ] [ 3.8267959e-10 1.7288612e-10 2.9300277e-10 ] [ 3.9332176e-10 4.0874515e-10 2.6841658e-10 ] [ 3.2111375e-10 4.3573341e-10 4.9606131e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.3e-06 1.33e-05 1.8e-06 ] [ 1.4e-06 8.7e-06 -8e-06 ] [ 1.2e-06 -9.6e-06 1.03e-05 ] [ 6.1e-06 4.4e-06 7e-07 ] [ -6.8e-06 -6.4e-06 -0.0 ] [ 4.5e-06 -1.04e-05 -4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.009371271104e-14 2.130894905664e-14 2.88391791744e-15 ] [ 2.24304726912e-15 1.393893660096e-14 -1.28174129664e-14 ] [ 1.92261194496e-15 -1.538089555968e-14 1.650241919424e-14 ] [ 9.77327738688e-15 7.04957713152e-15 1.12152363456e-15 ] [ -1.089480102144e-14 -1.025393037312e-14 0.0 ] [ 7.2097947936e-15 -1.666263685632e-14 -7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }