{ "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" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.82523 -11.0273357 -5.3939024 ] [ -17.091903 -30.1782411 39.2793585 ] [ 4.6722796 18.055144 1.388431 ] [ 21.4755299 20.0020626 -42.8933026 ] [ 3.7693235 3.1483702 7.6194154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.054828366238279e-08 -1.76677394482532e-08 -8.64198432015701e-09 ] [ -2.738424739158138e-08 -4.835087234728568e-08 6.293246986872176e-08 ] [ 7.485817140960776e-09 2.892752960197739e-08 2.224511687793964e-09 ] [ 3.440759192507137e-08 3.204683706549806e-08 -6.872264661461985e-08 ] [ 6.039121987932029e-09 5.04424512806342e-09 1.220764921804348e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3893627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.634710918951565e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4175294 2.4316972 0.8219759 ] [ 2.7309471 0.9573078 2.581486 ] [ 2.0513275 4.4926461 2.1624608 ] [ 3.4809883 1.0201755 0.0865734 ] [ 3.3073477 3.082487 3.8454073 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4175294e-10 2.4316972e-10 8.219759e-11 ] [ 2.7309471e-10 9.573078000000001e-11 2.581486e-10 ] [ 2.0513275e-10 4.4926461e-10 2.1624608e-10 ] [ 3.4809883e-10 1.0201755e-10 8.65734e-12 ] [ 3.3073477e-10 3.082487e-10 3.8454073e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.32e-05 1.88e-05 2.34e-05 ] [ -1.55e-05 3.46e-05 9.7e-06 ] [ -1.92e-05 -2.55e-05 -1.98e-05 ] [ 8.2e-06 2.12e-05 3.56e-05 ] [ 1.33e-05 -4.91e-05 -4.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.114873139456e-14 3.012092047104e-14 3.749093292672001e-14 ] [ -2.48337376224e-14 5.543531107968001e-14 1.554111322176e-14 ] [ -3.076179111936e-14 -4.08555038304e-14 -3.172309709184e-14 ] [ 1.313784829056e-14 3.396614436096001e-14 5.703748770048e-14 ] [ 2.130894905664e-14 -7.866687208128001e-14 -7.834643675712001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.178089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.592015596502165e-18 } }