{ "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" [ [ 0.7988983 0.4673865 0.2218489 ] [ 0.3258309 0.1815657 2.151485 ] [ 0.290514 2.993692 1.621534 ] [ 2.152844 0.6900228 1.637351 ] [ 2.682916 2.279137 0.4360972 ] [ 1.831466 2.039249 2.911237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.988983e-11 4.673865e-11 2.218489e-11 ] [ 3.258309e-11 1.815657e-11 2.151485e-10 ] [ 2.90514e-11 2.993692e-10 1.621534e-10 ] [ 2.152844e-10 6.900228e-11 1.637351e-10 ] [ 2.682916e-10 2.279137e-10 4.360972e-11 ] [ 1.831466e-10 2.039249e-10 2.911237e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9838049 -0.8284357 -16.7056202 ] [ -12.8854925 -3.8786502 11.0519724 ] [ -4.8228746 6.7921515 -1.4394728 ] [ 23.4770604 -17.4993247 -0.7518256 ] [ 0.0103371 5.7425637 -3.6472235 ] [ -0.7952254 9.6716954 11.4921696 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.984935759194705e-09 -1.327300321311434e-09 -2.67653543409184e-08 ] [ -2.064483500108224e-08 -6.214282721899427e-09 1.77072119388929e-08 ] [ -7.727096992832094e-09 1.088222642788805e-08 -2.306289685438555e-09 ] [ 3.761439760788669e-08 -2.803700914511905e-08 -1.20455740916303e-09 ] [ 1.65618600833214e-11 9.200601379396585e-09 -5.843496270675698e-09 ] [ -1.274091554643303e-09 1.549576438104528e-08 1.841248560708513e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7903264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.087930229531334e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7695857 0.7276204 -0.0200885 ] [ 0.1908087 0.4500125 2.4039201 ] [ 0.1332115 2.7263995 1.3538707 ] [ 2.5609434 0.1572825 1.6393123 ] [ 2.5033492 2.4336721 0.5892663 ] [ 1.9245707 2.1560661 3.0132722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.695857000000001e-11 7.276203999999999e-11 -2.00885e-12 ] [ 1.908087e-11 4.500125e-11 2.4039201e-10 ] [ 1.332115e-11 2.7263995e-10 1.3538707e-10 ] [ 2.5609434e-10 1.572825e-11 1.6393123e-10 ] [ 2.5033492e-10 2.4336721e-10 5.892663e-11 ] [ 1.9245707e-10 2.1560661e-10 3.0132722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-06 -6.5e-06 2e-07 ] [ -6.7e-06 -1.5e-06 -3.9e-06 ] [ -1.4e-06 8.7e-06 3.8e-06 ] [ 6e-06 1.09e-05 5.6e-06 ] [ 1e-06 -1.7e-06 -6.8e-06 ] [ 2.3e-06 -9.8e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.9226119608e-15 -1.0414148121e-14 3.204353268e-16 ] [ -1.07345834478e-14 -2.403264951e-15 -6.248488872599999e-15 ] [ -2.2430472876e-15 1.39389367158e-14 6.088271209199999e-15 ] [ 9.613059803999999e-15 1.74637253106e-14 8.972189150399999e-15 ] [ 1.602176634e-15 -2.7237002778e-15 -1.08948011112e-14 ] [ 3.685006258199999e-15 -1.57013310132e-14 1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.423038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.951696101089409e-18 } }