{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.0415393 -67.9039953 -15.2696992 ] [ -24.2834044 11.1560349 39.7188812 ] [ -20.6145327 13.973621 -30.806357 ] [ -10.7323672 18.7247258 0.3059817 ] [ 26.2580044 11.4992646 -36.7470186 ] [ 44.4138391 12.550349 42.798212 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.40992026073044e-08 -1.087941937285731e-07 -2.446475506488846e-08 ] [ -3.890630280311186e-08 1.787393829760887e-08 6.363666286297265e-08 ] [ -3.302812234065711e-08 2.238820887411992e-08 -4.935722495741842e-08 ] [ -1.719514781368076e-08 3.000031790765058e-08 4.902367261326393e-10 ] [ 4.206996075854353e-08 1.842385289851306e-08 -5.887521408502274e-08 ] [ 7.115881464599292e-08 2.010787575068066e-08 6.857029467844202e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 35.75198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.72809865033092e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1889207 -0.105689 1.2734137 ] [ 0.7587484 1.5220217 3.1809136 ] [ 0.6297024 1.8538292 -0.2499418 ] [ -0.3941717 2.9092295 1.6245399 ] [ 3.0600243 1.331531 0.081859 ] [ 3.1538125 1.0903967 2.5753429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1889207e-10 -1.05689e-11 1.2734137e-10 ] [ 7.587484000000001e-11 1.5220217e-10 3.1809136e-10 ] [ 6.297024e-11 1.8538292e-10 -2.499418e-11 ] [ -3.941717000000001e-11 2.9092295e-10 1.6245399e-10 ] [ 3.0600243e-10 1.331531e-10 8.1859e-12 ] [ 3.1538125e-10 1.0903967e-10 2.5753429e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.16e-05 -5.4e-06 -6e-07 ] [ -3.5e-06 9e-06 1.02e-05 ] [ -7.6e-06 4.9e-06 -1.32e-05 ] [ -1.09e-05 4.8e-06 8e-07 ] [ 3.2e-06 -1.4e-06 4.2e-06 ] [ 7.1e-06 -1.19e-05 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.858524880128e-14 -8.65175375232e-15 -9.6130597248e-16 ] [ -5.6076181728e-15 1.44195895872e-14 1.634220153216e-14 ] [ -1.217654231808e-14 7.850665441919999e-15 -2.114873139456e-14 ] [ -1.746372516672e-14 7.69044777984e-15 1.28174129664e-15 ] [ 5.126965186560001e-15 -2.24304726912e-15 6.72914180736e-15 ] [ 1.137545400768e-14 -1.906590178752e-14 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.180008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.271887730035697e-18 } }