{ "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" [ [ 1.103512 1.466985 2.426499 ] [ 2.074865 2.595365 4.552024 ] [ 1.591542 3.438653 2.256813 ] [ 3.435088 2.328735 1.940231 ] [ 4.699457 2.544305 3.846061 ] [ 3.437343 0.6039955 3.482177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.103512e-10 1.466985e-10 2.426499e-10 ] [ 2.074865e-10 2.595365e-10 4.552024e-10 ] [ 1.591542e-10 3.438653e-10 2.256813e-10 ] [ 3.435088e-10 2.328735e-10 1.940231e-10 ] [ 4.699457e-10 2.544305e-10 3.846061e-10 ] [ 3.437343e-10 6.039955e-11 3.482177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.876677 -5.2951301 1.1761112 ] [ 0.1915948 -0.4993471 -0.5768983 ] [ -1.4682077 7.1859008 0.2335904 ] [ 2.6669807 -0.9927891 -2.6157109 ] [ -0.2206502 -0.1124779 0.8882081 ] [ -0.2930406 -0.2861566 0.8946995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.404591393393082e-09 -8.483733650314365e-09 1.884337868101033e-09 ] [ 3.069687092268519e-10 -8.000422492842798e-10 -9.242929688392646e-10 ] [ -2.35232805141854e-09 1.151308226114802e-08 3.742530777233203e-10 ] [ 4.272974125664818e-09 -1.590623485405073e-09 -4.190830850751727e-09 ] [ -3.535205918148442e-10 -1.802094617366803e-10 1.423066252225188e-09 ] [ -4.695027982652045e-10 -4.584734144076173e-10 1.433466621541449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.925975279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.892282426783838e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3100744 1.3947807 2.4881266 ] [ 1.9833576 2.331917 4.6224097 ] [ 2.0934152 3.6876907 2.6133185 ] [ 3.4639101 1.9940974 1.5455217 ] [ 4.1371962 2.9312293 3.6798067 ] [ 3.3538535 0.6383234 3.5546218 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3100744e-10 1.3947807e-10 2.4881266e-10 ] [ 1.9833576e-10 2.331917e-10 4.622409700000001e-10 ] [ 2.0934152e-10 3.6876907e-10 2.6133185e-10 ] [ 3.4639101e-10 1.9940974e-10 1.5455217e-10 ] [ 4.1371962e-10 2.9312293e-10 3.6798067e-10 ] [ 3.3538535e-10 6.383234e-11 3.5546218e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.18e-05 2.11e-05 -1.23e-05 ] [ -1.47e-05 -1.8e-06 3.16e-05 ] [ -1.84e-05 -7e-06 -2.98e-05 ] [ -3e-06 -3.4e-06 2.2e-05 ] [ 2.37e-05 -9.6e-06 2e-06 ] [ 2.42e-05 9e-07 -1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.890568412544e-14 3.380592669888e-14 -1.970677243584e-14 ] [ -2.355199632576e-14 -2.88391791744e-15 5.062878121728e-14 ] [ -2.948004982272e-14 -1.12152363456e-14 -4.774486329984001e-14 ] [ -4.8065298624e-15 -5.44740051072e-15 3.52478856576e-14 ] [ 3.797158591296e-14 -1.538089555968e-14 3.2043532416e-15 ] [ 3.877267422336e-14 1.44195895872e-15 -2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }