{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8068997 0.6582047 1.0869811 ] [ 2.6552115 -2.8653938 -3.9450272 ] [ -0.0612371 0.8300225 -0.7582738 ] [ -0.7998249 1.5531149 1.877971 ] [ 0.0127502 -0.1759483 1.7383489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.894972455470534e-09 1.054560182040678e-09 1.741535705671467e-09 ] [ 4.254117788579299e-09 -4.590866955745271e-09 -6.320630348260086e-09 ] [ -9.81126499455917e-11 1.329842644237968e-09 -1.214888554525175e-09 ] [ -1.281460755513698e-09 2.48836438219613e-09 3.008841230740397e-09 ] [ 2.042807235052416e-11 -2.819002527295046e-10 2.785141966373397e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.091543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.57814939871979e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4542642 2.3219797 1.3333705 ] [ 2.3209393 4.2639434 2.7681232 ] [ 4.3826566 5.5097709 2.5565219 ] [ 3.4817135 4.3888922 0.6124422 ] [ 4.4527314 3.0947819 2.4542784 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4542642e-10 2.3219797e-10 1.3333705e-10 ] [ 2.3209393e-10 4.2639434e-10 2.7681232e-10 ] [ 4.3826566e-10 5.509770900000001e-10 2.5565219e-10 ] [ 3.4817135e-10 4.3888922e-10 6.124422e-11 ] [ 4.4527314e-10 3.0947819e-10 2.4542784e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -3.28e-05 -4.2e-06 ] [ 2.5e-05 3e-05 1.46e-05 ] [ -1.38e-05 -2.48e-05 2.19e-05 ] [ -9e-06 1.9e-05 -4.99e-05 ] [ -1.2e-06 8.6e-06 1.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-15 -5.255139316223999e-14 -6.72914180736e-15 ] [ 4.005441552e-14 4.8065298624e-14 2.339177866368e-14 ] [ -2.211003736704e-14 -3.973398019584e-14 3.508766799552e-14 ] [ -1.44195895872e-14 3.04413557952e-14 -7.994861337792e-14 ] [ -1.92261194496e-15 1.377871893888e-14 2.819830852608e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }