{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.273702 2.402034 1.908702 ] [ 1.908149 2.590409 4.360855 ] [ 2.360817 4.517724 2.766871 ] [ 3.26801 0.6931896 3.511788 ] [ 4.292326 2.985376 3.423625 ] [ 4.772846 4.542174 1.540942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.273702e-10 2.402034e-10 1.908702e-10 ] [ 1.908149e-10 2.590409e-10 4.360855e-10 ] [ 2.360817e-10 4.517724e-10 2.766871e-10 ] [ 3.26801e-10 6.931896e-11 3.511788e-10 ] [ 4.292326e-10 2.985376e-10 3.423625e-10 ] [ 4.772846e-10 4.542174e-10 1.540942e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3966686 -1.5401539 -2.7545064 ] [ -0.8082824 0.9371955 1.7682758 ] [ 2.8127805 1.9158446 -0.7239071 ] [ 0.5103023 -2.1066678 0.1186277 ] [ 0.8641227 1.3840855 -0.5614698 ] [ -2.9822545 -0.590304 2.1529797 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.355331571254668e-10 -2.467598571013941e-09 -4.413205755923973e-09 ] [ -1.295011164284114e-09 1.501552719218966e-09 2.833090145886417e-09 ] [ 4.506571156542134e-09 3.069521427205928e-09 -1.159827031251128e-09 ] [ 8.175944146004678e-10 -3.37525389695217e-09 1.900625275192762e-10 ] [ 1.384477187442572e-09 2.217549429288279e-09 -8.995737868452519e-10 ] [ -4.778098437175593e-09 -9.457712679647233e-10 3.449453740396998e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.284525 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.089721509823312e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1375695 2.0560424 1.8819087 ] [ 2.2284581 2.8977063 4.3523635 ] [ 2.3920081 4.4526315 2.4363321 ] [ 3.0957558 0.5873346 3.7273156 ] [ 4.3480213 2.7336087 2.9500149 ] [ 4.6740372 5.0035831 2.1648482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1375695e-10 2.0560424e-10 1.8819087e-10 ] [ 2.2284581e-10 2.8977063e-10 4.3523635e-10 ] [ 2.3920081e-10 4.4526315e-10 2.4363321e-10 ] [ 3.0957558e-10 5.873346000000001e-11 3.7273156e-10 ] [ 4.3480213e-10 2.7336087e-10 2.9500149e-10 ] [ 4.6740372e-10 5.0035831e-10 2.1648482e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 -9.9e-06 -3.47e-05 ] [ -8.28e-05 -1.85e-05 0.0001176 ] [ 4.11e-05 8.53e-05 -3.27e-05 ] [ -4.92e-05 -0.0001651 2.21e-05 ] [ 0.0001137 7.98e-05 -6.7e-06 ] [ -2.31e-05 2.84e-05 -6.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 -1.586154854592e-14 -5.559552874176001e-14 ] [ -1.3266022420224e-13 -2.96402674848e-14 1.8841597060608e-13 ] [ 6.584945911488e-14 1.3666566575424e-13 -5.239117550016001e-14 ] [ -7.882708974336e-14 -2.6451936009408e-13 3.540810331968e-14 ] [ 1.8216748178496e-13 1.2785369433984e-13 -1.073458335936e-14 ] [ -3.701027994048e-14 4.550181603071999e-14 -1.0510278632448e-13 ] ] } "relaxed-potential-energy" { "source-value" -20.309927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.254009020955468e-18 } }