{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.407706 -3.1051487 -0.7098874 ] [ -3.0647183 3.8121994 -2.6324291 ] [ 0.2225233 -0.187182 3.9701545 ] [ -1.1828308 0.8509497 0.2892898 ] [ 1.4045775 -1.1178921 -0.6393755 ] [ 0.0780172 0.0345018 0.3928235 ] [ -0.865275 -0.2874279 -0.6705758 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.459746883759885e-09 -4.974996651247513e-09 -1.137364995680498e-09 ] [ -4.91022000959792e-09 6.107816752507788e-09 -4.217616359933585e-09 ] [ 3.565216288432646e-10 -2.998986242345856e-10 6.360888720863914e-09 ] [ -1.895103854122161e-09 1.363371714816774e-09 4.634933541959078e-10 ] [ 2.250381232601712e-09 -1.791060587197016e-09 -1.02439247801231e-09 ] [ 1.249973338602778e-10 5.527797733551744e-11 6.293726278008289e-10 ] [ -1.38632337556272e-09 -4.605102615456403e-10 -1.074380869234257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.487818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.481421990680542e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3944178 0.9157091 2.3776751 ] [ 0.8804889 3.5049787 2.6327398 ] [ 2.0472893 1.9833084 3.9212837 ] [ 2.6493811 4.9888506 2.7127357 ] [ 4.9388665 2.6307431 2.4804771 ] [ 4.0555477 4.2158771 1.0506713 ] [ 3.6897317 3.554828 4.156254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3944178e-10 9.157091000000001e-11 2.3776751e-10 ] [ 8.804889e-11 3.5049787e-10 2.6327398e-10 ] [ 2.0472893e-10 1.9833084e-10 3.9212837e-10 ] [ 2.6493811e-10 4.9888506e-10 2.7127357e-10 ] [ 4.9388665e-10 2.6307431e-10 2.4804771e-10 ] [ 4.0555477e-10 4.2158771e-10 1.0506713e-10 ] [ 3.6897317e-10 3.554828e-10 4.156254e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -1.51e-05 1.92e-05 ] [ 8.4e-06 -9e-07 -1.08e-05 ] [ 9.4e-06 2.25e-05 -1.87e-05 ] [ -5.1e-06 -8.4e-06 8.8e-06 ] [ -1.9e-05 3.03e-05 -6.5e-06 ] [ -4e-07 -4.7e-06 1.8e-06 ] [ 1.43e-05 -2.37e-05 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 -2.419286697408e-14 3.076179111936e-14 ] [ 1.345828361472e-14 -1.44195895872e-15 -1.730350750464e-14 ] [ 1.506046023552e-14 3.604897396800001e-14 -2.996070280896e-14 ] [ -8.17110076608e-15 -1.345828361472e-14 1.409915426304e-14 ] [ -3.04413557952e-14 4.854595161024e-14 -1.04141480352e-14 ] [ -6.408706483200001e-16 -7.53023011776e-15 2.88391791744e-15 ] [ 2.291112567744e-14 -3.797158591296e-14 9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }