{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0819682 -0.9482002 -4.9799503 ] [ -5.180746 -3.0058786 2.9004089 ] [ -2.5253264 1.5476672 0.3940403 ] [ 0.2767712 -2.9263895 -1.0679505 ] [ 4.9861069 1.5911624 -3.0380818 ] [ 0.4802596 -0.7612112 2.8109397 ] [ 3.0449028 4.5028499 2.9805937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.733504154489058e-09 -1.519184192277884e-09 -7.978759943405946e-09 ] [ -8.300470119503116e-09 -4.815948417883034e-09 4.646967330340245e-09 ] [ -4.046018917969029e-09 2.479636204618998e-09 6.313221563130183e-10 ] [ 4.43436345950761e-10 -4.688592840254602e-09 -1.711045323271671e-09 ] [ 7.988623903989564e-09 2.549323197176018e-09 -4.867543632037982e-09 ] [ 7.694607030347598e-10 -1.219594788131113e-09 4.503621869818565e-09 ] [ 4.878472078768459e-09 7.214360836751618e-09 4.775437542243769e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.964096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.55773013834068e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6871286 2.4407811 0.6383847 ] [ 1.4777307 1.1333081 4.1308421 ] [ 1.895463 3.1502252 2.8302043 ] [ 4.9032315 -0.0820029 2.6617106 ] [ 4.9239873 2.0757562 1.5313262 ] [ 3.854745 0.9198057 4.6190491 ] [ 4.224305 3.1494014 3.6363459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6871286e-10 2.4407811e-10 6.383847e-11 ] [ 1.4777307e-10 1.1333081e-10 4.1308421e-10 ] [ 1.895463e-10 3.1502252e-10 2.8302043e-10 ] [ 4.903231500000001e-10 -8.20029e-12 2.6617106e-10 ] [ 4.9239873e-10 2.0757562e-10 1.5313262e-10 ] [ 3.854745e-10 9.198057e-11 4.6190491e-10 ] [ 4.224305e-10 3.1494014e-10 3.6363459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 -8.5e-06 3.7e-06 ] [ 4.6e-06 -9.3e-06 -2e-07 ] [ 7e-07 9.6e-06 -2.7e-06 ] [ -8e-07 -1.1e-06 -4.9e-06 ] [ -7.9e-06 -3e-07 9.2e-06 ] [ -5.4e-06 8.6e-06 -8.7e-06 ] [ 6.6e-06 1e-06 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 -1.36185012768e-14 5.928053496960001e-15 ] [ 7.370012455680001e-15 -1.490024257344e-14 -3.2043532416e-16 ] [ 1.12152363456e-15 1.538089555968e-14 -4.32587687616e-15 ] [ -1.28174129664e-15 -1.76239428288e-15 -7.850665441919999e-15 ] [ -1.265719530432e-14 -4.8065298624e-16 1.474002491136e-14 ] [ -8.65175375232e-15 1.377871893888e-14 -1.393893660096e-14 ] [ 1.057436569728e-14 1.6021766208e-15 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.146068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.387973577144701e-18 } }