{ "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" [ [ 2.5720614 -7.4941728 -19.5150452 ] [ -12.0225001 7.6659902 13.0687354 ] [ 0.1145842 -0.3131563 0.1291845 ] [ 0.6061026 -1.0062589 -0.0989043 ] [ 8.7297519 1.1475978 6.4160296 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.120896642342117e-09 -1.200698845239528e-08 -3.126654917329526e-08 ] [ -1.926216858378566e-08 1.228227027372192e-08 2.093842232130134e-08 ] [ 1.835841263530714e-10 -5.01731702516231e-10 2.069763856697376e-10 ] [ 9.71083415526094e-10 -1.612204484051925e-09 -1.584621571565894e-10 ] [ 1.398660439956438e-08 1.838654365241514e-09 1.027961262348077e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.781068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.057938751255015e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2485196 1.8357252 -0.2475974 ] [ 0.1665698 3.3092756 1.4925813 ] [ 1.8390173 0.2704182 0.2282531 ] [ 2.7400481 0.7765588 2.262525 ] [ 1.7064204 2.6546757 3.0439236 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.485196e-11 1.8357252e-10 -2.475974e-11 ] [ 1.665698e-11 3.3092756e-10 1.4925813e-10 ] [ 1.8390173e-10 2.704182e-11 2.282531e-11 ] [ 2.7400481e-10 7.765588e-11 2.262525e-10 ] [ 1.7064204e-10 2.6546757e-10 3.0439236e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.63e-05 -2.1e-05 -1.4e-06 ] [ 1.66e-05 -1.7e-06 2.33e-05 ] [ -1.23e-05 1.93e-05 5.4e-06 ] [ -3.9e-06 -1.7e-06 -8.2e-06 ] [ -1.67e-05 5.2e-06 -1.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.611547891904e-14 -3.36457090368e-14 -2.24304726912e-15 ] [ 2.659613190528e-14 -2.72370025536e-15 3.733071526464e-14 ] [ -1.970677243584e-14 3.092200878144e-14 8.65175375232e-15 ] [ -6.24848882112e-15 -2.72370025536e-15 -1.313784829056e-14 ] [ -2.675634956736e-14 8.33131842816e-15 -3.060157345728e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.078032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.935114049567427e-18 } }