{ "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" [ [ 2.180035 1.415878 2.755479 ] [ 0.3300308 2.592052 2.653614 ] [ 2.100058 3.620481 1.423788 ] [ 2.171562 4.236408 3.751897 ] [ 3.719666 3.140383 2.648489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.180035e-10 1.415878e-10 2.755479e-10 ] [ 3.300308e-11 2.592052e-10 2.653614e-10 ] [ 2.100058e-10 3.620481e-10 1.423788e-10 ] [ 2.171562e-10 4.236408e-10 3.751897e-10 ] [ 3.719666e-10 3.140383e-10 2.648489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9207558 -7.7781346 0.9712298 ] [ -7.6688308 -0.9270427 0.4230899 ] [ -0.9816749 3.4468497 -7.6249475 ] [ -0.8330152 5.3629111 5.8637266 ] [ 8.5627651 -0.1045836 0.3669012 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.475213416226001e-09 -1.246194540955556e-08 1.55608167898426e-09 ] [ -1.228682141663096e-08 -1.485286140423308e-09 6.7786474627661e-10 ] [ -1.572816574006178e-09 5.522462004751494e-09 -1.221651261932741e-08 ] [ -1.334637478211036e-09 8.59233078384881e-09 9.394725669283074e-09 ] [ 1.371906205262217e-08 -1.675613988390989e-10 5.878405247834649e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 32.747379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.246708502627689e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5819159 -1.9706037 3.1415744 ] [ -3.380991 2.3175002 2.8615674 ] [ 1.8546295 4.9378504 -1.591986 ] [ 1.8297586 6.3534085 6.115959 ] [ 7.6160389 3.3670466 2.7061521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5819159e-10 -1.9706037e-10 3.1415744e-10 ] [ -3.380991e-10 2.3175002e-10 2.8615674e-10 ] [ 1.8546295e-10 4.9378504e-10 -1.591986e-10 ] [ 1.8297586e-10 6.3534085e-10 6.115959000000001e-10 ] [ 7.616038900000001e-10 3.3670466e-10 2.7061521e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }