{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4846013 -4.5700885 -3.6161824 ] [ -8.4284116 -1.8396442 2.2359541 ] [ -1.0455123 2.3488671 -1.5667375 ] [ 1.6956479 -0.4772678 4.922763 ] [ 6.2936747 4.5381334 -1.9757972 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.378593494069287e-09 -7.322088949686941e-09 -5.793762897828434e-09 ] [ -1.350380401599952e-08 -2.94743492783032e-09 3.582393384201905e-09 ] [ -1.675095363818836e-09 3.763299952986296e-09 -2.51019019343064e-09 ] [ 2.716727422488616e-09 -7.646673110206503e-10 7.88713578833927e-09 ] [ 1.008357846326046e-08 7.270891235551615e-09 -3.165576081282102e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.9722373 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.966402355129716e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.010388 0.8883966 1.78814 ] [ 1.2178367 1.7063811 3.1827757 ] [ 1.7684088 3.7847074 2.0851545 ] [ 3.0668516 2.3546645 4.5928174 ] [ 4.0125949 2.9787985 2.4612984 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.010388e-10 8.883966e-11 1.78814e-10 ] [ 1.2178367e-10 1.7063811e-10 3.1827757e-10 ] [ 1.7684088e-10 3.7847074e-10 2.0851545e-10 ] [ 3.0668516e-10 2.3546645e-10 4.5928174e-10 ] [ 4.0125949e-10 2.9787985e-10 2.4612984e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 -1.1e-06 8e-07 ] [ 6.4e-06 -0.0 -1.3e-06 ] [ 2.2e-06 -5e-07 1.5e-06 ] [ -8e-07 1.6e-06 -5e-06 ] [ -4.5e-06 0.0 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 -1.76239428288e-15 1.28174129664e-15 ] [ 1.025393037312e-14 0.0 -2.08282960704e-15 ] [ 3.52478856576e-15 -8.010883104e-16 2.4032649312e-15 ] [ -1.28174129664e-15 2.56348259328e-15 -8.010883104e-15 ] [ -7.2097947936e-15 0.0 6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }