{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5117359 1.3589607 -0.8443989 ] [ 1.1296868 0.1135189 0.6642597 ] [ -2.8564821 -1.8253514 1.9475062 ] [ -1.9980722 -3.0920434 0.1108633 ] [ -0.688471 1.0855075 -0.541015 ] [ 4.5176783 1.9795733 -1.6825742 ] [ 0.4073961 0.3798344 0.345359 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.198913017589605e-10 2.177295080064283e-09 -1.352876187355302e-09 ] [ 1.809957794698231e-09 1.818773290973826e-10 1.06426137024785e-09 ] [ -4.576588876059251e-09 -2.924535361919188e-09 3.120248928210131e-09 ] [ -3.201264591884974e-09 -4.953999686793915e-09 1.776225888281322e-10 ] [ -1.103052149386614e-09 1.739174752531755e-09 -8.6680159164351e-10 ] [ 7.238118612188842e-09 3.171626086550272e-09 -2.695781068211242e-09 ] [ 6.527205122027274e-10 6.085618004694096e-10 5.533261201416061e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.536691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.251646626387809e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1730321 1.2058304 3.7178197 ] [ 1.2950083 2.558249 3.7727873 ] [ 2.2415702 4.6365045 3.3344838 ] [ 2.7933959 2.7349173 1.8730441 ] [ 3.2525239 3.2464131 4.9742212 ] [ 4.1922347 4.6691964 2.0751673 ] [ 4.8267199 2.774864 3.2587986 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1730321e-10 1.2058304e-10 3.7178197e-10 ] [ 1.2950083e-10 2.558249e-10 3.7727873e-10 ] [ 2.2415702e-10 4.6365045e-10 3.3344838e-10 ] [ 2.7933959e-10 2.7349173e-10 1.8730441e-10 ] [ 3.2525239e-10 3.2464131e-10 4.9742212e-10 ] [ 4.1922347e-10 4.6691964e-10 2.0751673e-10 ] [ 4.8267199e-10 2.774864e-10 3.2587986e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 3.74e-05 -4.85e-05 ] [ 4.27e-05 9.4e-06 8.8e-06 ] [ 4.57e-05 -2.06e-05 6.4e-06 ] [ -1.61e-05 -1.08e-05 -4.35e-05 ] [ -1.84e-05 1.08e-05 3.99e-05 ] [ -2.54e-05 -6.31e-05 1.17e-05 ] [ -3.9e-05 3.69e-05 2.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6822854657e-14 5.99214061116e-14 -7.770556674899999e-14 ] [ 6.84129422718e-14 1.50604603596e-14 1.40991543792e-14 ] [ 7.32194721738e-14 -3.300483866039999e-14 1.02539304576e-14 ] [ -2.579504380739999e-14 -1.73035076472e-14 -6.969468357899999e-14 ] [ -2.94800500656e-14 1.73035076472e-14 6.392684769659999e-14 ] [ -4.06952865036e-14 -1.010973456054e-13 1.87454666178e-14 ] [ -6.248488872599999e-14 5.91203177946e-14 4.053506884019999e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497209018275e-18 } }