{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.860772 3.213277 0.634813 ] [ 3.47304 1.055338 1.294101 ] [ 4.886118 2.711251 1.984131 ] [ 3.680898 4.652345 1.961095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.860772e-10 3.213277e-10 6.34813e-11 ] [ 3.47304e-10 1.055338e-10 1.294101e-10 ] [ 4.886118e-10 2.711251e-10 1.984131e-10 ] [ 3.680898e-10 4.652345e-10 1.961095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0144105 -2.9281724 -1.2679863 ] [ -0.3259441 -0.0988226 -0.1894845 ] [ -0.8309992 0.2843644 -0.7468735 ] [ 1.1425328 2.7426306 2.2043442 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.308816638425699e-11 -4.691449399603701e-09 -2.031538022092114e-09 ] [ -5.222200210101593e-10 -1.583312606311284e-10 -3.03587638405173e-10 ] [ -1.331407501112693e-09 4.556019972214296e-10 -1.196623270253799e-09 ] [ 1.830539355738595e-09 4.3941786630134e-09 3.531748770533422e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.665446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.029228164038876e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2549829 3.2006375 0.164284 ] [ 3.174661 1.6771928 1.9040428 ] [ 5.1388783 2.8131683 1.4507153 ] [ 3.3323058 3.9412125 2.3550979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2549829e-10 3.2006375e-10 1.64284e-11 ] [ 3.174661e-10 1.6771928e-10 1.9040428e-10 ] [ 5.1388783e-10 2.8131683e-10 1.4507153e-10 ] [ 3.3323058e-10 3.9412125e-10 2.3550979e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.61e-05 -6.5e-06 2.66e-05 ] [ 7.4e-06 -4e-07 -1.1e-05 ] [ -3.1e-05 3.2e-06 -5.7e-06 ] [ 7.5e-06 3.7e-06 -9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.579504380739999e-14 -1.0414148121e-14 4.26178984644e-14 ] [ 1.18561070916e-14 -6.408706536e-16 -1.7623942974e-14 ] [ -4.966747565399999e-14 5.1269652288e-15 -9.1324068138e-15 ] [ 1.2016324755e-14 5.9280535458e-15 -1.58615486766e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }