{ "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" [ [ 4.132036289994203e-09 -1.575480157553012e-08 1.504063502593088e-09 ] [ -1.378244411307405e-09 1.465296307494376e-08 -1.1021618198311e-09 ] [ -1.874520546300866e-09 -2.312620205754816e-09 6.716561571869831e-10 ] [ -1.196653230956855e-09 -4.326428701432749e-09 -9.306370511849066e-09 ] [ 1.112079453413223e-09 -4.560189957339608e-09 1.408522649750297e-08 ] [ -7.946977150599641e-10 1.23010775253312e-08 -5.852414146038206e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.429754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.151683805916804e-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" [ [ 2.94800500656e-14 -8.4915361602e-15 -6.8893595262e-15 ] [ 1.37787190524e-14 -1.2016324755e-14 2.13089492322e-14 ] [ -1.63422016668e-14 -1.3618501389e-14 1.32980660622e-14 ] [ -2.65961321244e-14 -5.767835882399999e-15 -4.806529901999999e-15 ] [ -1.7623942974e-14 1.08948011112e-14 -1.71432899838e-14 ] [ 1.73035076472e-14 2.8839179412e-14 -5.767835882399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.026204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.888116284851733e-18 } }