{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.089476 2.842372 2.086496 ] [ 5.601196 2.528242 2.896237 ] [ 3.884312 0.6907176 1.701618 ] [ 4.215674 4.038258 3.881982 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.089476e-10 2.842372e-10 2.086496e-10 ] [ 5.601196e-10 2.528242e-10 2.896237e-10 ] [ 3.884312e-10 6.907176000000001e-11 1.701618e-10 ] [ 4.215674e-10 4.038258e-10 3.881982e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0208498 -0.1753601 0.6938902 ] [ -1.7732522 -1.2665524 -0.9795525 ] [ 1.0984046 2.0001943 1.0297482 ] [ -0.3460021 -0.5582818 -0.7440859 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.635581682908356e-09 -2.809578524411501e-10 1.111734655842236e-09 ] [ -2.841063217622165e-09 -2.02924064429813e-09 -1.569416114346192e-09 ] [ 1.759838170299176e-09 3.204664544517421e-09 1.649838491350883e-09 ] [ -5.543564753677037e-10 -8.944660477781416e-10 -1.192157032846927e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9970974 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.601711573014047e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6385406 2.8775985 2.20055 ] [ 5.7567835 2.1721845 3.0826357 ] [ 4.1392132 1.237094 1.8183396 ] [ 4.2561207 3.8127126 3.4648078 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6385406e-10 2.8775985e-10 2.20055e-10 ] [ 5.7567835e-10 2.1721845e-10 3.0826357e-10 ] [ 4.1392132e-10 1.237094e-10 1.8183396e-10 ] [ 4.256120700000001e-10 3.8127126e-10 3.4648078e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.75e-05 3.7e-06 -2.39e-05 ] [ -2.46e-05 1.65e-05 -1.05e-05 ] [ 2.36e-05 3.57e-05 4.25e-05 ] [ 3.85e-05 -5.6e-05 -8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.008162327999999e-14 5.928053496960001e-15 -3.829202123712e-14 ] [ -3.941354487168e-14 2.64359142432e-14 -1.68228545184e-14 ] [ 3.781136825088e-14 5.719770536256001e-14 6.8092506384e-14 ] [ 6.16837999008e-14 -8.97218907648e-14 -1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736330714483474e-18 } }