{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.7434632 -19.3228175 -70.3980104 ] [ -29.7613685 18.9249233 51.7707515 ] [ 1.3704137 -1.6419971 2.5615485 ] [ 0.5105364 -4.3451682 1.2722262 ] [ 22.1369552 6.3850595 14.7934843 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.202042461465155e-09 -3.09585664464851e-08 -1.127900464137153e-07 ] [ -4.768296881371357e-08 3.032106966169319e-08 8.294588769454654e-08 ] [ 2.195644790964025e-09 -2.6307693650414e-09 4.104053119745309e-09 ] [ 8.179694841473971e-10 -6.961726903483618e-09 2.038331074009225e-09 ] [ 3.546731207713698e-08 1.022999305331694e-08 2.370177468563185e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.19528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.915205222490983e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4388024 2.022476 -0.1602581 ] [ -0.2011974 3.103258 1.7707855 ] [ 2.0030036 0.5037177 0.2909786 ] [ 2.4807407 0.499148 2.5444992 ] [ 1.9792258 2.7180539 2.3336805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.388024e-11 2.022476e-10 -1.602581e-11 ] [ -2.011974e-11 3.103258e-10 1.7707855e-10 ] [ 2.0030036e-10 5.037177e-11 2.909786e-11 ] [ 2.4807407e-10 4.99148e-11 2.5444992e-10 ] [ 1.9792258e-10 2.7180539e-10 2.3336805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.67e-05 1.89e-05 -8.74e-05 ] [ -1.17e-05 -2.98e-05 2.5e-06 ] [ -1.6e-05 5.7e-06 4.18e-05 ] [ 1.01e-05 -4e-06 5.4e-06 ] [ 5.42e-05 9.2e-06 3.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.879988198335999e-14 3.028113813312e-14 -1.4003023665792e-13 ] [ -1.874546646336e-14 -4.774486329984001e-14 4.005441552e-15 ] [ -2.56348259328e-14 9.13240673856e-15 6.697098274944e-14 ] [ 1.618198387008e-14 -6.4087064832e-15 8.65175375232e-15 ] [ 8.683797284736e-14 1.474002491136e-14 6.040205860416e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.049734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.411233196405887e-18 } }