{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.594467 -9.8270623 -4.4182596 ] [ -5.8696983 -3.6763904 5.5770553 ] [ -10.095188 3.0319643 -5.5661946 ] [ 2.175952 -3.7079276 -2.6776709 ] [ 9.0697309 2.6360186 9.1604078 ] [ 1.098154 2.7891688 -0.7994602 ] [ 14.2155164 8.7542288 -1.2758778 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.697420747708407e-08 -1.57446895979223e-08 -7.078832294066186e-09 ] [ -9.40429346488952e-09 -5.890226796341912e-09 8.935427688185858e-09 ] [ -1.617427432943719e-08 4.857742356582166e-09 -8.918026928416975e-09 ] [ 3.486259451105568e-09 -5.940754961283699e-09 -4.29010174952175e-09 ] [ 1.453131092464779e-08 4.223367407709392e-09 1.467659133507134e-08 ] [ 1.759436679333636e-09 4.468741079641819e-09 -1.280876452252967e-09 ] [ 2.277576821632379e-08 1.402582083204986e-08 -2.044181598999325e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2592034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.323270270293335e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7216613 0.9444786 2.615363 ] [ 1.9948332 2.9166815 4.3077427 ] [ 1.5435179 3.938184 2.1742075 ] [ 4.1355117 1.428525 2.0437203 ] [ 4.4615342 2.4717668 4.252729 ] [ 3.6853286 3.6353882 1.0896362 ] [ 4.238818 4.7866809 3.2761163 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7216613e-10 9.444786e-11 2.615363e-10 ] [ 1.9948332e-10 2.9166815e-10 4.307742700000001e-10 ] [ 1.5435179e-10 3.938184e-10 2.1742075e-10 ] [ 4.1355117e-10 1.428525e-10 2.0437203e-10 ] [ 4.4615342e-10 2.4717668e-10 4.252729000000001e-10 ] [ 3.6853286e-10 3.6353882e-10 1.0896362e-10 ] [ 4.238818e-10 4.7866809e-10 3.2761163e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 2.07e-05 1.63e-05 ] [ -6e-06 8.5e-06 -9.38e-05 ] [ 4.46e-05 4.53e-05 7.12e-05 ] [ -4.2e-06 -1.15e-05 6.6e-06 ] [ 7.42e-05 -8.01e-05 4.1e-05 ] [ 6e-07 -5.94e-05 -6.59e-05 ] [ -0.0001071 7.65e-05 2.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.364570931399999e-15 3.316505632379999e-14 2.61154791342e-14 ] [ -9.613059803999999e-15 1.3618501389e-14 -1.502841682692e-13 ] [ 7.145707787639999e-14 7.25786015202e-14 1.140749763408e-13 ] [ -6.729141862799999e-15 -1.8425031291e-14 1.05743657844e-14 ] [ 1.188815062428e-13 -1.283343483834e-13 6.568924199399999e-14 ] [ 9.613059803999998e-16 -9.51692920596e-14 -1.055834401806e-13 ] [ -1.715931175014e-13 1.22566512501e-13 3.94135451964e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.495245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.963264937910533e-18 } }