{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3873737 0.7634221 -0.7806136 ] [ 0.3971093 -0.767577 -0.1647239 ] [ -0.0793887 2.1631506 1.1839535 ] [ 0.0268161 -1.2866987 -0.6799992 ] [ 0.4501462 -0.0532229 -0.5765599 ] [ -0.5479446 -0.3651251 0.3108826 ] [ 0.1406353 -0.453949 0.7070606 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.206410907661257e-10 1.223137050499211e-09 -1.250680870102622e-09 ] [ 6.36239241604096e-10 -1.229793934195818e-09 -2.639167836413526e-10 ] [ -1.271947201436358e-10 3.46574934714308e-09 1.896902633442519e-09 ] [ 4.296412883500739e-11 -2.061518592138176e-09 -1.089478829378693e-09 ] [ 7.212137235238907e-10 -8.527248677371858e-11 -9.237507998813765e-10 ] [ -8.779040348464762e-10 -5.849949037069133e-10 4.980888376371684e-10 ] [ 2.253225915755802e-10 -7.273064808276659e-10 1.13283597214202e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.186415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.394437907122711e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6020144 3.8773522 2.8944299 ] [ 5.7608015 2.2558897 1.3100969 ] [ 3.6483883 1.3159668 1.0860588 ] [ 3.2437246 1.6979761 3.3786477 ] [ 5.3587553 2.6354123 3.5879342 ] [ 4.8016933 4.382239 1.992524 ] [ 3.0040277 3.4977842 0.6165955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6020144e-10 3.8773522e-10 2.8944299e-10 ] [ 5.760801500000001e-10 2.2558897e-10 1.3100969e-10 ] [ 3.6483883e-10 1.3159668e-10 1.0860588e-10 ] [ 3.2437246e-10 1.6979761e-10 3.3786477e-10 ] [ 5.358755300000001e-10 2.6354123e-10 3.5879342e-10 ] [ 4.8016933e-10 4.382239e-10 1.992524e-10 ] [ 3.0040277e-10 3.4977842e-10 6.165955e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.5e-05 -2.1e-06 2.85e-05 ] [ -5.4e-06 -8.9e-06 4e-07 ] [ -2.93e-05 -5.47e-05 -2.41e-05 ] [ 2.5e-05 -1.77e-05 1.2e-05 ] [ -5.3e-06 3.3e-05 1.23e-05 ] [ 2.31e-05 1.48e-05 2.6e-06 ] [ 1.68e-05 3.55e-05 -3.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.005441585e-14 -3.364570931399999e-15 4.5662034069e-14 ] [ -8.6517538236e-15 -1.42593720426e-14 6.408706536e-16 ] [ -4.69437753762e-14 -8.76390618798e-14 -3.86124568794e-14 ] [ 4.005441585e-14 -2.83585264218e-14 1.9226119608e-14 ] [ -8.4915361602e-15 5.287182892199999e-14 1.97067725982e-14 ] [ 3.70102802454e-14 2.37122141832e-14 4.165659248399999e-15 ] [ 2.691656745119999e-14 5.6877270507e-14 -5.09492169612e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }