{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3619693 -4.1081914 3.674447 ] [ -5.5569006 3.9744372 -17.8234012 ] [ -6.2857584 1.1055252 19.9718582 ] [ 8.7048868 -4.7037519 -3.6176078 ] [ 7.4997415 3.731981 -2.2052962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.988645290685335e-09 -6.582048269079747e-09 5.887113126271397e-09 ] [ -8.903136298780578e-09 6.367750415140385e-09 -2.855623694104756e-08 ] [ -1.007089523544922e-08 1.771246643738176e-09 3.199844454560129e-08 ] [ 1.394676623257503e-08 -7.536241386313104e-09 -5.796046688136144e-09 ] [ 1.201591059234011e-08 5.979292756731954e-09 -3.53327404268899e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7130164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.551084751738797e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2852856 0.1550385 2.2526572 ] [ 0.6585757 1.1979423 0.1423987 ] [ 0.8649452 2.4656038 2.1788408 ] [ 2.7862932 0.6399037 -0.4212114 ] [ 3.0934951 2.52692 2.6101608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.852856e-11 1.550385e-11 2.2526572e-10 ] [ 6.585757e-11 1.1979423e-10 1.423987e-11 ] [ 8.649452e-11 2.4656038e-10 2.1788408e-10 ] [ 2.7862932e-10 6.399037e-11 -4.212114e-11 ] [ 3.0934951e-10 2.52692e-10 2.6101608e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.19e-05 1e-07 -1.69e-05 ] [ -7.2e-06 -2.67e-05 9.8e-06 ] [ 1.04e-05 -6.1e-06 -8.5e-06 ] [ -5.3e-06 2.41e-05 1.71e-05 ] [ 2.4e-05 8.5e-06 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.50876682846e-14 1.602176634e-16 -2.70767851146e-14 ] [ -1.15356717648e-14 -4.277811612779999e-14 1.57013310132e-14 ] [ 1.66626369936e-14 -9.773277467399999e-15 -1.3618501389e-14 ] [ -8.4915361602e-15 3.86124568794e-14 2.73972204414e-14 ] [ 3.8452239216e-14 1.3618501389e-14 -2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.996903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.92211576669645e-18 } }