{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.360944 2.643853 2.165766 ] [ 2.694587 4.80447 3.102481 ] [ 4.665525 1.923814 2.374826 ] [ 4.545146 3.928705 1.722535 ] [ 3.943017 3.203445 4.218269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.360944e-10 2.643853e-10 2.165766e-10 ] [ 2.694587e-10 4.80447e-10 3.102481e-10 ] [ 4.665525e-10 1.923814e-10 2.374826e-10 ] [ 4.545146e-10 3.928705e-10 1.722535e-10 ] [ 3.943017e-10 3.203445e-10 4.218269e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.0969907 -5.4950341 -4.5856174 ] [ -3.6126469 6.3549466 1.2722154 ] [ 4.7398762 -8.7959139 -0.4851179 ] [ 7.4369942 8.8844586 -9.643954 ] [ 2.5327671 -0.9484572 13.4424739 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.777933906077503e-08 -8.80401516551877e-09 -7.346968990213683e-09 ] [ -5.788098402385596e-09 1.018174686895245e-08 2.03831377050172e-09 ] [ 7.594118833126345e-09 -1.409260760914975e-08 -7.772445577115924e-10 ] [ 1.19153782362652e-08 1.42344718573855e-08 -1.545131763087064e-08 ] [ 4.057940233551416e-09 -1.51959595166943e-09 2.15372174082942e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.9982002 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.007999506517885e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0933138 2.4602523 2.065226 ] [ 2.7770327 4.6698117 3.0059776 ] [ 4.5066525 1.9319018 2.427571 ] [ 4.7577252 4.253617 1.543687 ] [ 4.0744949 3.1887042 4.5414154 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0933138e-10 2.4602523e-10 2.065226e-10 ] [ 2.7770327e-10 4.6698117e-10 3.0059776e-10 ] [ 4.5066525e-10 1.9319018e-10 2.427571e-10 ] [ 4.757725200000001e-10 4.253617e-10 1.543687e-10 ] [ 4.0744949e-10 3.1887042e-10 4.5414154e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.8e-06 -1.4e-05 -9.5e-06 ] [ -9e-07 2.45e-05 9e-06 ] [ 8.3e-06 -1.82e-05 -5e-06 ] [ -2e-07 6.2e-06 -9e-06 ] [ -1.4e-06 1.5e-06 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.292624400640001e-15 -2.24304726912e-14 -1.52206778976e-14 ] [ -1.44195895872e-15 3.92533272096e-14 1.44195895872e-14 ] [ 1.329806595264e-14 -2.915961449856e-14 -8.010883104e-15 ] [ -3.2043532416e-16 9.93349504896e-15 -1.44195895872e-14 ] [ -2.24304726912e-15 2.4032649312e-15 2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }