{ "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" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5790142 -9.8333737 0.9387626 ] [ -0.8602325 9.1456602 -0.6879153 ] [ -1.1699837 -1.443424 0.4192148 ] [ -0.7468922 -2.7003444 -5.8085796 ] [ 0.6941054 -2.8462467 8.7913069 ] [ -0.4960113 7.6777287 -3.6527896 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.132036255951216e-09 -1.575480144572959e-08 1.504063490201422e-09 ] [ -1.378244399952336e-09 1.465296295422105e-08 -1.102161810750618e-09 ] [ -1.874520530857081e-09 -2.312620186701619e-09 6.716561516533479e-10 ] [ -1.196653221097878e-09 -4.326428665788204e-09 -9.306370435175817e-09 ] [ 1.112079444251032e-09 -4.560189919769152e-09 1.408522638145772e-08 ] [ -7.946977085126151e-10 1.230107742398518e-08 -5.852414097821384e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.429754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.151683788189528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3885109 0.2496292 0.1730374 ] [ 0.3481967 2.6472004 0.0002961 ] [ 0.3481881 1.5521978 2.2302677 ] [ 2.60889 -0.2279527 0.578458 ] [ 2.7399062 1.1402077 2.4314277 ] [ 2.0201307 3.2804352 1.6061017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.885109e-11 2.496292e-11 1.730374e-11 ] [ 3.481967000000001e-11 2.6472004e-10 2.961e-14 ] [ 3.481881e-11 1.5521978e-10 2.2302677e-10 ] [ 2.60889e-10 -2.279527e-11 5.78458e-11 ] [ 2.7399062e-10 1.1402077e-10 2.4314277e-10 ] [ 2.0201307e-10 3.2804352e-10 1.6061017e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.84e-05 -5.3e-06 -4.3e-06 ] [ 8.6e-06 -7.5e-06 1.33e-05 ] [ -1.02e-05 -8.5e-06 8.3e-06 ] [ -1.66e-05 -3.6e-06 -3e-06 ] [ -1.1e-05 6.8e-06 -1.07e-05 ] [ 1.08e-05 1.8e-05 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.948004982272e-14 -8.491536090240001e-15 -6.889359469440001e-15 ] [ 1.377871893888e-14 -1.2016324656e-14 2.130894905664e-14 ] [ -1.634220153216e-14 -1.36185012768e-14 1.329806595264e-14 ] [ -2.659613190528e-14 -5.76783583488e-15 -4.8065298624e-15 ] [ -1.76239428288e-14 1.089480102144e-14 -1.714328984256e-14 ] [ 1.730350750464e-14 2.88391791744e-14 -5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.026204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.888116261057145e-18 } }