{ "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" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3331618 -13.0420671 -7.5985778 ] [ -3.5039435 -0.0270184 7.2885483 ] [ 1.0844688 8.7837669 -8.1176473 ] [ -2.2797283 1.8697344 3.7211888 ] [ 8.3297658 -3.6907366 9.5479332 ] [ 1.7003998 5.121447 -5.5939822 ] [ 2.0021992 0.9848737 0.7525371 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.174902048930138e-08 -2.089569516668014e-08 -1.217426380279112e-08 ] [ -5.613936402556179e-09 -4.32882491680656e-11 1.167754178204042e-08 ] [ 1.737510571662019e-09 1.407314608568261e-08 -1.300590482711319e-08 ] [ -3.652527414128542e-09 2.995644767466009e-09 5.962001746062498e-09 ] [ 1.334575613145232e-08 -5.913211942768605e-09 1.529747547603285e-08 ] [ 2.724340828018273e-09 8.205462715669396e-09 -8.962547571851914e-09 ] [ 3.207876774853493e-09 1.577941629581126e-09 1.205697357838121e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.740146 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.201414086894856e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5296197 1.732216 1.6389303 ] [ 2.3305405 2.4210134 4.0698455 ] [ 2.6170138 4.076643 0.8724714 ] [ 1.9017789 4.7393276 3.1397881 ] [ 4.6863813 1.9668274 2.9491898 ] [ 4.9435071 4.1529081 1.6928644 ] [ 4.2001117 4.2958775 4.1116114 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5296197e-10 1.732216e-10 1.6389303e-10 ] [ 2.3305405e-10 2.4210134e-10 4.0698455e-10 ] [ 2.6170138e-10 4.076643e-10 8.724714e-11 ] [ 1.9017789e-10 4.7393276e-10 3.1397881e-10 ] [ 4.6863813e-10 1.9668274e-10 2.9491898e-10 ] [ 4.9435071e-10 4.152908100000001e-10 1.6928644e-10 ] [ 4.2001117e-10 4.2958775e-10 4.1116114e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.19e-05 4.6e-06 -1.5e-06 ] [ 2.14e-05 1.48e-05 -8.2e-06 ] [ 4e-07 -1.52e-05 2.85e-05 ] [ 1.03e-05 -4e-06 -2.41e-05 ] [ -4.25e-05 3.1e-06 -6e-07 ] [ -1.06e-05 1.25e-05 -2.59e-05 ] [ -9e-07 -1.58e-05 3.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.50876682846e-14 7.370012516399999e-15 -2.403264951e-15 ] [ 3.42865799676e-14 2.37122141832e-14 -1.31378483988e-14 ] [ 6.408706536e-16 -2.43530848368e-14 4.5662034069e-14 ] [ 1.65024193302e-14 -6.408706535999999e-15 -3.86124568794e-14 ] [ -6.8092506945e-14 4.9667475654e-15 -9.613059803999998e-16 ] [ -1.69830723204e-14 2.0027207925e-14 -4.149637482059999e-14 ] [ -1.4419589706e-15 -2.53143908172e-14 5.09492169612e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759062264992e-18 } }