{ "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" [ [ 0.9320143 3.012582 2.150962 ] [ 2.172573 2.316103 4.293659 ] [ 2.198257 4.51425 3.345177 ] [ 3.106694 2.5483 1.973249 ] [ 3.92193 5.175884 1.747773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.320143e-11 3.012582e-10 2.150962e-10 ] [ 2.172573e-10 2.316103e-10 4.293659e-10 ] [ 2.198257e-10 4.51425e-10 3.345177e-10 ] [ 3.106694e-10 2.5483e-10 1.973249e-10 ] [ 3.92193e-10 5.175884e-10 1.747773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.822289 -0.4996096 -0.3522846 ] [ 0.0584791 -0.504723 0.0194106 ] [ 0.7605421 2.1641784 0.3972221 ] [ 3.3339265 2.4183696 -0.7886236 ] [ -1.3306587 -3.5782153 0.7242755 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.521805452941012e-09 -8.004628206472397e-10 -5.644221499878797e-10 ] [ 9.369384682542528e-11 -8.086553905800385e-10 3.109920951570048e-11 ] [ 1.218522771754136e-09 3.467396035720351e-09 6.364199618850798e-10 ] [ 5.341539093765571e-09 3.874655233573448e-09 -1.263514294531131e-09 ] [ -2.131950259404121e-09 -5.732932897848858e-09 1.16041727311823e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.270356 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.965927751209301e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9314609 3.0456847 2.1818917 ] [ 2.4095341 2.509542 4.0564872 ] [ 1.9591489 4.8009705 3.4702875 ] [ 3.2371869 2.4697359 1.7958392 ] [ 3.7941375 4.7411859 2.0063145 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.314609e-11 3.0456847e-10 2.1818917e-10 ] [ 2.4095341e-10 2.509542e-10 4.0564872e-10 ] [ 1.9591489e-10 4.8009705e-10 3.4702875e-10 ] [ 3.237186900000001e-10 2.4697359e-10 1.7958392e-10 ] [ 3.7941375e-10 4.741185899999999e-10 2.0063145e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 5e-06 1.16e-05 ] [ 6e-06 -5e-07 3e-06 ] [ -1.83e-05 -6.3e-06 -1.08e-05 ] [ -4.2e-06 5.2e-06 -7.4e-06 ] [ 1.63e-05 -3.5e-06 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 8.010883104e-15 1.858524880128e-14 ] [ 9.6130597248e-15 -8.010883104e-16 4.8065298624e-15 ] [ -2.931983216064e-14 -1.009371271104e-14 -1.730350750464e-14 ] [ -6.72914180736e-15 8.33131842816e-15 -1.185610699392e-14 ] [ 2.611547891904e-14 -5.6076181728e-15 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }