{ "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" [ [ 0.6853579 1.38516 2.167247 ] [ 2.540934 0.807992 2.62106 ] [ 2.939018 2.435595 0.7846409 ] [ 2.909365 2.687518 2.904649 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.853579e-11 1.38516e-10 2.167247e-10 ] [ 2.540934e-10 8.079920000000001e-11 2.62106e-10 ] [ 2.939018e-10 2.435595e-10 7.846409e-11 ] [ 2.909365000000001e-10 2.687518e-10 2.904649e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2552191 -0.9047539 -0.2217317 ] [ 1.8567501 -5.6773817 1.3994204 ] [ 1.9965463 1.6809773 -4.1877788 ] [ 2.4019226 4.9011583 3.0100901 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.002196580000162e-08 -1.449575546157621e-09 -3.552533458302394e-10 ] [ 2.974841600888062e-09 -9.09616822709776e-09 2.242118647550584e-09 ] [ 3.198819804204743e-09 2.693222530155508e-09 -6.70956128644188e-09 ] [ 3.84830423469115e-09 7.852521243099872e-09 4.822695984721534e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5304942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.86082850871e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9057966 1.0725487 1.4176655 ] [ 2.2680469 0.6671454 3.3732401 ] [ 2.2692672 2.9910059 0.8655798 ] [ 3.6315642 2.5855649 2.8211115 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.057966e-11 1.0725487e-10 1.4176655e-10 ] [ 2.2680469e-10 6.671454e-11 3.3732401e-10 ] [ 2.2692672e-10 2.9910059e-10 8.655798e-11 ] [ 3.6315642e-10 2.5855649e-10 2.8211115e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.11e-05 -2.86e-05 1.74e-05 ] [ 2.66e-05 -5.1e-06 -8.2e-06 ] [ 2.75e-05 3.5e-05 -5.06e-05 ] [ -3e-06 -1.3e-06 4.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.187122532288001e-14 -4.582225135488e-14 2.787787320192e-14 ] [ 4.261789811328e-14 -8.17110076608e-15 -1.313784829056e-14 ] [ 4.4059857072e-14 5.6076181728e-14 -8.107013701248e-14 ] [ -4.8065298624e-15 -2.08282960704e-15 6.633011210111999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }