{ "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" [ [ 4.2959231 -9.6659134 -1.6291837 ] [ -10.6837967 3.2500706 -5.1267578 ] [ -3.3940466 -3.0943862 9.0514399 ] [ -0.8840528 8.6725471 2.1955665 ] [ 8.5177196 -1.0669901 -0.211208 ] [ 1.7091824 2.5254134 -6.9664922 ] [ 0.439071 -0.6207414 2.6866352 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.882827555574661e-09 -1.548650046815744e-08 -2.610240035128441e-09 ] [ -1.711732929412019e-08 5.207187131269428e-09 -8.213971487664043e-09 ] [ -5.437862112425729e-09 -4.957753225366154e-09 1.450200539235629e-08 ] [ -1.416408727712778e-09 1.389495220640684e-08 3.517685315711683e-09 ] [ 1.364689120564993e-08 -1.709506592845054e-09 -3.383925197259264e-10 ] [ 2.738412081962834e-09 4.046158307335039e-09 -1.116155093182556e-08 ] [ 7.034692910712768e-10 -9.945373586426611e-10 4.304464106058333e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2075374 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536864811821618e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.5715691 0.6613796 2.6180963 ] [ 1.4461578 3.8218021 2.0603898 ] [ 1.9053912 2.043271 3.7225414 ] [ 2.5196738 5.4191486 3.5465919 ] [ 4.9130442 2.6669114 2.3163509 ] [ 3.4038045 3.5858642 0.6925006 ] [ 3.8960824 3.595918 4.3753658 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5715691e-10 6.613796e-11 2.6180963e-10 ] [ 1.4461578e-10 3.8218021e-10 2.0603898e-10 ] [ 1.9053912e-10 2.043271e-10 3.7225414e-10 ] [ 2.5196738e-10 5.4191486e-10 3.5465919e-10 ] [ 4.9130442e-10 2.6669114e-10 2.3163509e-10 ] [ 3.4038045e-10 3.5858642e-10 6.925006e-11 ] [ 3.8960824e-10 3.595918000000001e-10 4.3753658e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.8e-06 -3.6e-06 7.1e-06 ] [ -5e-06 2.2e-06 -2.63e-05 ] [ 1.13e-05 -6e-06 1.21e-05 ] [ -1.74e-05 2.57e-05 1.48e-05 ] [ 5.7e-06 -9.8e-06 -1.79e-05 ] [ 2.4e-06 1.6e-06 -1.7e-05 ] [ 8.7e-06 -1.01e-05 2.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.292624400640001e-15 -5.76783583488e-15 1.137545400768e-14 ] [ -8.010883104e-15 3.52478856576e-15 -4.213724512704e-14 ] [ 1.810459581504e-14 -9.6130597248e-15 1.938633711168e-14 ] [ -2.787787320192e-14 4.117593915456e-14 2.371221398784e-14 ] [ 9.13240673856e-15 -1.570133088384e-14 -2.867896151232001e-14 ] [ 3.84522388992e-15 2.56348259328e-15 -2.72370025536e-14 ] [ 1.393893660096e-14 -1.618198387008e-14 4.373942174784e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }