{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5030166 -6.4866339 4.0512743 ] [ -5.4679928 3.3217326 -19.8302021 ] [ -5.2597308 3.1659836 21.5525647 ] [ 9.073794 -4.3751523 -4.2733386 ] [ 8.1569462 4.37407 -1.5002982 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.041898116119431e-08 -1.039273318226873e-08 6.490856967907886e-09 ] [ -8.76069022686273e-09 5.322002312269197e-09 -3.177148619035906e-08 ] [ -8.427017719461681e-09 5.072464905756219e-09 3.453101528061937e-08 ] [ 1.453782060875531e-08 -7.009766727499348e-09 -6.846643197682203e-09 ] [ 1.30688684987634e-08 7.008032691742656e-09 -2.403742700268322e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.81229687 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.301443054263017e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0290764 0.1986419 2.3159929 ] [ 0.9396701 0.9963993 0.1283492 ] [ 1.0531542 2.472991 2.1428478 ] [ 2.7142817 0.1094735 -1.025752 ] [ 2.9524123 3.2079025 3.2014081 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.90764e-12 1.986419e-11 2.3159929e-10 ] [ 9.396700999999999e-11 9.963993e-11 1.283492e-11 ] [ 1.0531542e-10 2.472991e-10 2.1428478e-10 ] [ 2.7142817e-10 1.094735e-11 -1.025752e-10 ] [ 2.952412300000001e-10 3.2079025e-10 3.2014081e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 -3.5e-06 -2.6e-06 ] [ 1.26e-05 -1.08e-05 -1.61e-05 ] [ 8.6e-06 2.3e-06 1.06e-05 ] [ -1.41e-05 9.8e-06 1.4e-05 ] [ -1.9e-06 2.1e-06 -5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.17110076608e-15 -5.6076181728e-15 -4.16565921408e-15 ] [ 2.018742542208e-14 -1.730350750464e-14 -2.579504359488e-14 ] [ 1.377871893888e-14 3.68500622784e-15 1.698307218048e-14 ] [ -2.259069035328e-14 1.570133088384e-14 2.24304726912e-14 ] [ -3.04413557952e-15 3.36457090368e-15 -9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.141118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.624786216837406e-18 } }