{ "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" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2529456 -1.1214827 0.1332562 ] [ 2.6061752 -1.3296967 2.159114 ] [ -7.3026569 -8.696635 -2.9520325 ] [ 7.9494274 11.1478144 0.6596623 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.211793389054228e-09 -1.79681336257166e-09 2.134999682166489e-10 ] [ 4.175552975148764e-09 -2.130408965494911e-09 3.459281972441972e-09 ] [ -1.17001461549038e-08 -1.393354527663101e-08 -4.729677455341777e-09 ] [ 1.273638672902693e-08 1.786076760469758e-08 1.056895514683156e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3670508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.996786693605938e-19 } "relaxed-configuration-positions" { "source-value" [ [ 5.4893662 2.4833388 2.8827144 ] [ 3.3850976 1.9073546 2.4684547 ] [ 4.8790409 5.3524266 1.2687299 ] [ 3.4004944 3.701187 1.17619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.4893662e-10 2.4833388e-10 2.8827144e-10 ] [ 3.3850976e-10 1.9073546e-10 2.4684547e-10 ] [ 4.8790409e-10 5.352426600000001e-10 1.2687299e-10 ] [ 3.4004944e-10 3.701187e-10 1.17619e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1919092 -0.790177 0.1011347 ] [ 1.4767677 0.6003586 0.0249217 ] [ -1.8558829 -1.759968 -0.3437595 ] [ 1.5710244 1.9497864 0.2177031 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.909649054356432e-09 -1.266003115693882e-09 1.620356518916218e-10 ] [ 2.366042683292588e-09 9.61880513016219e-10 3.992896509059136e-11 ] [ -2.973452193322504e-09 -2.819779582956134e-09 -5.507634340778976e-10 ] [ 2.517058564386347e-09 3.123902185633797e-09 3.487988170956845e-10 ] ] } "relaxed-potential-energy" { "source-value" -7.1587519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.146958492828758e-18 } }