{ "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" [ [ -1.697420733723711e-08 -1.574468946820507e-08 -7.07883223574516e-09 ] [ -9.404293387409504e-09 -5.89022674781356e-09 8.935427614568731e-09 ] [ -1.617427419618071e-08 4.857742316560237e-09 -8.918026854943208e-09 ] [ 3.486259422383002e-09 -5.940754912339055e-09 -4.290101714176494e-09 ] [ 1.453131080492734e-08 4.223367372913947e-09 1.467659121415396e-08 ] [ 1.759436664838004e-09 4.468741042824792e-09 -1.280876441700092e-09 ] [ 2.277576802867898e-08 1.402582071649404e-08 -2.044181582157738e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2592034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.323270259391187e-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" [ [ -3.36457090368e-15 3.316505605055999e-14 2.611547891904e-14 ] [ -9.6130597248e-15 1.36185012768e-14 -1.5028416703104e-13 ] [ 7.145707728768e-14 7.257860092224001e-14 1.1407497540096e-13 ] [ -6.72914180736e-15 -1.84250311392e-14 1.057436569728e-14 ] [ 1.1888150526336e-13 -1.2833434732608e-13 6.56892414528e-14 ] [ 9.6130597248e-16 -9.516929127552e-14 -1.0558343931072e-13 ] [ -1.7159311608768e-13 1.225665114912e-13 3.941354487168e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.495245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.96326491349681e-18 } }