{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.723407 -5.0389236 -3.3403643 ] [ -0.9851737 2.7935941 1.8270993 ] [ 1.27811 2.7239328 -2.1429203 ] [ 0.4510604 -1.0526191 2.0689546 ] [ 2.0133988 -1.3949989 4.2130272 ] [ -1.0629629 2.3394087 -2.0242255 ] [ 0.0289746 -0.3703941 -0.6015709 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.761202403523066e-09 -8.073245585917372e-09 -5.351853586414957e-09 ] [ -1.578422269567033e-09 4.475831155024818e-09 2.927335782340045e-09 ] [ 2.047757960810688e-09 4.364221448790283e-09 -3.433336804897723e-09 ] [ 7.226784274486962e-10 -1.686481712627537e-09 3.314830689616616e-09 ] [ 3.225820485706775e-09 -2.235034623621717e-09 6.750013682634486e-09 ] [ -1.703054307157769e-09 3.748145925636121e-09 -3.243166771327191e-09 ] [ 4.642242671703168e-11 -5.934367675022574e-10 -9.638228317336147e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.485056 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.121850117817877e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6816764 1.8257166 1.6796047 ] [ 2.2757871 2.4361186 3.9517937 ] [ 2.6391068 4.0677529 0.9860518 ] [ 2.0277477 4.7333487 3.1500758 ] [ 4.6908388 2.3163735 2.9960342 ] [ 4.9222034 3.8878388 1.2645325 ] [ 3.9715927 4.117664 4.4466081 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6816764e-10 1.8257166e-10 1.6796047e-10 ] [ 2.2757871e-10 2.4361186e-10 3.9517937e-10 ] [ 2.6391068e-10 4.0677529e-10 9.860518e-11 ] [ 2.0277477e-10 4.733348699999999e-10 3.150075800000001e-10 ] [ 4.6908388e-10 2.3163735e-10 2.9960342e-10 ] [ 4.9222034e-10 3.8878388e-10 1.2645325e-10 ] [ 3.9715927e-10 4.117664000000001e-10 4.4466081e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-05 -2.34e-05 -4.9e-06 ] [ -3.31e-05 3.24e-05 -1.2e-06 ] [ -2.68e-05 -1.94e-05 4.5e-06 ] [ 2.48e-05 -7.8e-06 5.6e-06 ] [ -9.8e-06 -5.3e-06 -1.37e-05 ] [ 7.2e-06 3.15e-05 3.29e-05 ] [ 1.77e-05 -8e-06 -2.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-14 -3.749093292672001e-14 -7.850665441919999e-15 ] [ -5.303204614848e-14 5.191052251392001e-14 -1.92261194496e-15 ] [ -4.293833343744e-14 -3.108222644352e-14 7.2097947936e-15 ] [ 3.973398019584e-14 -1.249697764224e-14 8.972189076479999e-15 ] [ -1.570133088384e-14 -8.491536090240001e-15 -2.194981970496e-14 ] [ 1.153567166976e-14 5.04685635552e-14 5.271161082432e-14 ] [ 2.835852618816e-14 -1.28174129664e-14 -3.701027994048e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.951751 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.517058223782303e-18 } }