{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0909404 0.3504436 2.335509 ] [ 2.174921 0.6476227 0.0631824 ] [ 2.07151 0.3484765 2.894541 ] [ 2.345183 1.577217 1.820601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.09404e-12 3.504436000000001e-11 2.335509e-10 ] [ 2.174921e-10 6.476227e-11 6.31824e-12 ] [ 2.07151e-10 3.484765e-11 2.894541e-10 ] [ 2.345183e-10 1.577217e-10 1.820601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.9057554 -2.9541366 -6.2089095 ] [ -5.2507521 -28.1823856 -47.0654042 ] [ -88.1859695 -514.9289246 452.7923388 ] [ 125.342477 546.0654468 -399.5180251 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.111865537084335e-08 -4.733048595169601e-09 -9.947769641563018e-09 ] [ -8.412632256236503e-09 -4.515315932669058e-08 -7.540709025774214e-08 ] [ -1.412894986154818e-07 -8.25007084367806e-07 7.254532993027127e-07 ] [ 2.008207862425617e-07 8.748932922896662e-07 -6.400984394034076e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 130.84621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.096387385822872e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2161314 -0.3114923 1.8577219 ] [ 1.4309649 0.9312399 0.014616 ] [ 1.9102172 0.5307754 3.5423274 ] [ 3.1252409 1.7732368 1.6991681 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.161314e-11 -3.114923e-11 1.8577219e-10 ] [ 1.4309649e-10 9.312399e-11 1.4616e-12 ] [ 1.9102172e-10 5.307754e-11 3.5423274e-10 ] [ 3.1252409e-10 1.7732368e-10 1.6991681e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.89e-05 1.48e-05 -9.5e-06 ] [ 2.63e-05 -2.32e-05 4.08e-05 ] [ 7e-07 -3.38e-05 4.9e-06 ] [ 1.9e-06 4.22e-05 -3.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.630290434112001e-14 2.371221398784e-14 -1.52206778976e-14 ] [ 4.213724512704e-14 -3.717049760256e-14 6.536880612864e-14 ] [ 1.12152363456e-15 -5.415356978304e-14 7.850665441919999e-15 ] [ 3.04413557952e-15 6.761185339776e-14 -5.815901133504e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.481807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999805936073779e-18 } }