{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9234137 -5.6601585 -8.8764258 ] [ 1.3476084 0.1976532 4.9730361 ] [ -6.1550549 -0.8345365 -9.5230633 ] [ -4.1900383 0.5427429 14.6806882 ] [ 10.5557503 -2.0649397 2.8724294 ] [ -2.6239354 -1.0878112 -5.6045529 ] [ 0.1422562 8.9070498 1.4778883 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.479471841466425e-09 -9.068573618722396e-09 -1.422160189302594e-08 ] [ 2.159106672473695e-09 3.166753360663066e-10 7.967682173814412e-09 ] [ -9.861485060520481e-09 -1.337074869504259e-09 -1.52576293776585e-08 ] [ -6.713181404516578e-09 8.695699854851924e-10 2.352105541129444e-08 ] [ 1.691217634566258e-08 -3.308398110701765e-09 4.602139229578572e-09 ] [ -4.204007952369497e-09 -1.742865672484393e-09 -8.97948362641684e-09 ] [ 2.279195578038489e-10 1.427066694986131e-08 2.367838082413857e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.459192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27792391028584e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9098263 1.1355321 2.6241671 ] [ 2.4307497 2.6113761 0.5463203 ] [ 1.0204031 2.8190394 2.5867317 ] [ 1.9865177 2.0545873 4.7818461 ] [ 2.9200534 4.0913921 3.5858148 ] [ 4.4547394 3.0186426 1.9366807 ] [ 4.4466634 2.1975634 4.3161929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9098263e-10 1.1355321e-10 2.6241671e-10 ] [ 2.4307497e-10 2.6113761e-10 5.463203e-11 ] [ 1.0204031e-10 2.8190394e-10 2.5867317e-10 ] [ 1.9865177e-10 2.0545873e-10 4.781846100000001e-10 ] [ 2.9200534e-10 4.0913921e-10 3.5858148e-10 ] [ 4.4547394e-10 3.0186426e-10 1.9366807e-10 ] [ 4.446663400000001e-10 2.1975634e-10 4.3161929e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.78e-05 -2.13e-05 2.4e-05 ] [ 3.31e-05 -2.5e-06 -9e-06 ] [ -3.21e-05 -1.48e-05 4.6e-06 ] [ -3.38e-05 -6.93e-05 2.64e-05 ] [ 1.12e-05 0.000106 2.45e-05 ] [ 4.53e-05 -1.8e-05 -1.46e-05 ] [ 1.4e-05 2e-05 -5.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.056227626623999e-14 -3.412636202304e-14 3.84522388992e-14 ] [ 5.303204614848e-14 -4.005441552e-15 -1.44195895872e-14 ] [ -5.142986952768e-14 -2.371221398784e-14 7.370012455680001e-15 ] [ -5.415356978304e-14 -1.1103083982144e-13 4.229746278912e-14 ] [ 1.794437815296e-14 1.698307218048e-13 3.92533272096e-14 ] [ 7.257860092224001e-14 -2.88391791744e-14 -2.339177866368e-14 ] [ 2.24304726912e-14 3.2043532416e-14 -8.97218907648e-14 ] ] } "relaxed-potential-energy" { "source-value" -27.211343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.359737757516974e-18 } }