{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7149211 -0.0349741 0.1445719 ] [ -1.1549834 -0.5333684 0.9812303 ] [ 0.1762553 0.9135605 -0.6870346 ] [ 0.3085749 0.1932152 -0.7068245 ] [ -0.0447678 -0.5384331 0.2680569 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.145429881573577e-09 -5.60346858151794e-11 2.316297201129846e-10 ] [ -1.850487416137876e-09 -8.545503877939654e-10 1.57210425923281e-09 ] [ 2.823921232786602e-10 1.463685286845357e-09 -1.100750782869536e-09 ] [ 4.943914946188866e-10 3.095648787736368e-10 -1.132457698238733e-09 ] [ -7.172592311558519e-11 -8.626649317921853e-10 4.294745017624745e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.478251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999236218538713e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8859969 1.2707623 2.0472463 ] [ 1.0391013 1.9420607 3.4133469 ] [ 1.8481675 3.3965065 1.6840142 ] [ 3.2468799 1.8245654 4.3474393 ] [ 4.0559344 3.2790533 2.6181393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8859969e-10 1.2707623e-10 2.0472463e-10 ] [ 1.0391013e-10 1.9420607e-10 3.4133469e-10 ] [ 1.8481675e-10 3.3965065e-10 1.6840142e-10 ] [ 3.2468799e-10 1.8245654e-10 4.3474393e-10 ] [ 4.0559344e-10 3.2790533e-10 2.6181393e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1.94e-05 1.47e-05 ] [ 3.35e-05 -2.11e-05 -7.9e-06 ] [ 1.84e-05 1.46e-05 2e-05 ] [ -2.92e-05 1.08e-05 4.3e-06 ] [ -2.26e-05 -2.37e-05 -3.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 3.10822266996e-14 2.35519965198e-14 ] [ 5.367291723899999e-14 -3.38059269774e-14 -1.26571954086e-14 ] [ 2.94800500656e-14 2.33917788564e-14 3.204353268e-14 ] [ -4.67835577128e-14 1.73035076472e-14 6.8893595262e-15 ] [ -3.62091919284e-14 -3.79715862258e-14 -4.982769331739999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }