{ "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" [ [ 0.8164278 0.1663691 0.8726527 ] [ 0.2293415 1.783801 2.502887 ] [ 2.371717 0.4239938 0.3261347 ] [ 1.905698 2.704881 0.8462502 ] [ 2.020767 2.181943 2.752956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.164278e-11 1.663691e-11 8.726527e-11 ] [ 2.293415e-11 1.783801e-10 2.502887e-10 ] [ 2.371717e-10 4.239938e-11 3.261347e-11 ] [ 1.905698e-10 2.704881e-10 8.462502e-11 ] [ 2.020767e-10 2.181943e-10 2.752956e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.2021207 -7.9216337 8.7288878 ] [ -18.7633721 -4.505888 0.453303 ] [ 30.1624299 4.0982048 -13.5558924 ] [ 2.5702066 3.2142095 -11.6814584 ] [ 17.2328563 5.1151075 16.0551601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.999130830491973e-08 -1.26918563126814e-08 1.398521995874635e-08 ] [ -3.0062236105991e-08 -7.21922840954327e-09 7.262714687385025e-10 ] [ 4.832554001229888e-08 6.566047917810341e-09 -2.17189338773604e-08 ] [ 4.117924925145857e-09 5.149731315253257e-09 -1.871575954532778e-08 ] [ 2.7610079473466e-08 8.195305649378735e-09 2.572320215542099e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.7507209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.611493957925935e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4102305 -0.1566743 1.0191967 ] [ 0.0813095 1.2344438 2.8498137 ] [ 2.2020333 0.675602 -0.2020058 ] [ 2.9805315 2.5811143 0.8738876 ] [ 1.6698464 2.9265021 2.7599885 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.102305e-11 -1.566743e-11 1.0191967e-10 ] [ 8.130950000000001e-12 1.2344438e-10 2.8498137e-10 ] [ 2.2020333e-10 6.756020000000001e-11 -2.020058e-11 ] [ 2.9805315e-10 2.5811143e-10 8.738876e-11 ] [ 1.6698464e-10 2.9265021e-10 2.7599885e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.25e-05 -5.29e-05 -4.37e-05 ] [ 1.99e-05 3.73e-05 6.4e-06 ] [ -5e-07 1.49e-05 3.07e-05 ] [ 3.5e-06 -7.9e-06 -3.26e-05 ] [ -1.04e-05 8.6e-06 3.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.002720776e-14 -8.475514324032001e-14 -7.001511832895999e-14 ] [ 3.188331475392e-14 5.976118795584e-14 1.025393037312e-14 ] [ -8.010883104e-16 2.387243164992e-14 4.918682225856e-14 ] [ 5.6076181728e-15 -1.265719530432e-14 -5.223095783807999e-14 ] [ -1.666263685632e-14 1.377871893888e-14 6.280532353535999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.437183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992656383121121e-18 } }