{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 91.9567481 -48.3006521 5.9675934 ] [ -91.829921 101.6327621 -96.082083 ] [ 48.5383074 -18.9848412 134.3734512 ] [ -25.5543418 35.9825025 -23.594545 ] [ 10.254037 -37.7429115 -17.116088 ] [ 5.454547 3.4678659 -5.3551293 ] [ -38.8193767 -36.0547257 1.8068007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.473309519306148e-07 -7.738617556401444e-08 9.561138627920383e-09 ] [ -1.47127752516111e-07 1.628336353439483e-07 -1.539404670603651e-07 ] [ 7.776694132948364e-08 -3.041706872024062e-08 2.152900019688497e-07 ] [ -4.094256899189219e-08 5.765032426337756e-08 -3.780262837741353e-08 ] [ 1.642877835021817e-08 -6.047081040622346e-08 -2.742299603315543e-08 ] [ 8.739147680454778e-09 5.556133669049551e-09 -8.57986296582107e-09 ] [ -6.219549778276826e-08 -5.776603858589691e-08 2.894813839985075e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 33.496683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.36676023769488e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1993389 1.1162048 1.9157442 ] [ 1.0324883 3.3426554 2.1176548 ] [ 1.8693714 1.7824288 4.2999776 ] [ 3.0956479 5.2823417 2.8704332 ] [ 5.2625064 3.0558997 2.6685505 ] [ 3.4287587 3.64767 0.466879 ] [ 3.7676113 3.5670945 4.9925973 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1993389e-10 1.1162048e-10 1.9157442e-10 ] [ 1.0324883e-10 3.3426554e-10 2.1176548e-10 ] [ 1.8693714e-10 1.7824288e-10 4.2999776e-10 ] [ 3.0956479e-10 5.2823417e-10 2.8704332e-10 ] [ 5.262506400000001e-10 3.0558997e-10 2.6685505e-10 ] [ 3.4287587e-10 3.64767e-10 4.66879e-11 ] [ 3.7676113e-10 3.5670945e-10 4.9925973e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.8e-06 1.8e-05 2.34e-05 ] [ -1.83e-05 -2e-06 -2.97e-05 ] [ 2.88e-05 2.62e-05 1.37e-05 ] [ -8.5e-06 2.32e-05 -2.74e-05 ] [ 6.1e-06 -1.17e-05 -1.86e-05 ] [ -4.6e-06 4.7e-06 1.49e-05 ] [ -1.32e-05 -5.85e-05 2.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.570133088384e-14 2.88391791744e-14 3.749093292672001e-14 ] [ -2.931983216064e-14 -3.2043532416e-15 -4.758464563776e-14 ] [ 4.614268667904e-14 4.197702746496e-14 2.194981970496e-14 ] [ -1.36185012768e-14 3.717049760256e-14 -4.389963940992e-14 ] [ 9.77327738688e-15 -1.874546646336e-14 -2.980048514688e-14 ] [ -7.370012455680001e-15 7.53023011776e-15 2.387243164992e-14 ] [ -2.114873139456e-14 -9.37273323168e-14 3.781136825088e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120207089015e-18 } }