{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3855201 -7.0478628 -4.5070388 ] [ -11.9488473 -5.5627975 0.2061963 ] [ -3.3799715 3.0220388 4.0353696 ] [ 4.0852569 11.95588 -1.7717118 ] [ 5.8580418 -2.3672585 2.0371848 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.628554395068478e-09 -1.129192100476603e-08 -7.221072194398487e-09 ] [ -1.91441637895692e-08 -8.912584100744689e-09 3.30362891155463e-10 ] [ -5.415311316270308e-09 4.841839912510486e-09 6.465374829407048e-09 ] [ 6.545303095141884e-09 1.915543141709031e-08 -2.838595224755486e-09 ] [ 9.385617615629149e-09 -3.792766224090077e-09 3.263929858809124e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1796811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.696587340819627e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5562441 0.7304023 1.3126118 ] [ 0.5498625 1.4818523 2.6413295 ] [ 0.6812724 3.7971601 2.4936654 ] [ 2.6352554 4.1836511 2.8567144 ] [ 3.5506035 2.0753793 3.19889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5562441e-10 7.304022999999999e-11 1.3126118e-10 ] [ 5.498625e-11 1.4818523e-10 2.6413295e-10 ] [ 6.812724e-11 3.7971601e-10 2.4936654e-10 ] [ 2.6352554e-10 4.1836511e-10 2.8567144e-10 ] [ 3.5506035e-10 2.0753793e-10 3.19889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 1.48e-05 -1.4e-06 ] [ 1.35e-05 -3.32e-05 1.73e-05 ] [ -1.96e-05 4.21e-05 -1.88e-05 ] [ 2.5e-06 2.5e-06 3e-07 ] [ 2.4e-06 -2.63e-05 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 2.371221398784e-14 -2.24304726912e-15 ] [ 2.16293843808e-14 -5.319226381056e-14 2.771765553984e-14 ] [ -3.140266176767999e-14 6.745163573568001e-14 -3.012092047104e-14 ] [ 4.005441552e-15 4.005441552e-15 4.8065298624e-16 ] [ 3.84522388992e-15 -4.213724512704e-14 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.174815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.790402733476516e-18 } }