{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4147919 0.1188417 2.672415 ] [ 0.6892124 1.667561 0.0898235 ] [ 0.5303116 1.702107 2.13154 ] [ 2.147495 1.160279 2.850921 ] [ 1.555523 2.957039 1.141113 ] [ 2.952569 2.336763 2.431712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.147919e-11 1.188417e-11 2.672415e-10 ] [ 6.892124e-11 1.667561e-10 8.98235e-12 ] [ 5.303116e-11 1.702107e-10 2.13154e-10 ] [ 2.147495e-10 1.160279e-10 2.850921e-10 ] [ 1.555523e-10 2.957039e-10 1.141113e-10 ] [ 2.952569e-10 2.336763e-10 2.431712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5464609 -18.8890759 4.4314051 ] [ -3.7128262 -5.433545 -11.2191685 ] [ -21.5536059 11.2294418 0.5701092 ] [ 1.3793605 -29.8037509 19.7001151 ] [ 4.0388827 18.2257585 -8.6243865 ] [ 26.3946499 24.6711715 -4.8580744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.048858660296133e-08 -3.026363579549672e-08 7.099893648513886e-09 ] [ -5.948603334733704e-09 -8.705498767064735e-09 -1.797508947551581e-08 ] [ -3.453268346691694e-08 1.799154911659427e-08 9.134156315429914e-10 ] [ 2.209979144754999e-09 -4.775087290412696e-08 3.156306384028906e-08 ] [ 6.471003436093581e-09 2.920088416504688e-08 -1.381779041904314e-08 ] [ 4.228889098398106e-08 3.952757418504727e-08 -7.783493225786986e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 14.665264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.349634311865989e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4677919 0.190598 3.063582 ] [ 0.7106703 1.7078776 -0.4159066 ] [ -0.3467674 1.8164306 1.7529397 ] [ 2.6594181 0.551215 3.3827803 ] [ 1.5069866 3.2705937 1.2447376 ] [ 3.2918035 2.4058758 2.2893916 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.677919e-11 1.90598e-11 3.063582e-10 ] [ 7.106703e-11 1.7078776e-10 -4.159066e-11 ] [ -3.467674e-11 1.8164306e-10 1.7529397e-10 ] [ 2.6594181e-10 5.512150000000001e-11 3.3827803e-10 ] [ 1.5069866e-10 3.2705937e-10 1.2447376e-10 ] [ 3.2918035e-10 2.4058758e-10 2.2893916e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.58e-05 3.2e-06 -1.96e-05 ] [ 2.91e-05 -1.8e-06 -3.46e-05 ] [ -1.17e-05 -1.49e-05 6.29e-05 ] [ 1.84e-05 2.72e-05 -1.15e-05 ] [ -2.9e-06 -1.05e-05 4.6e-06 ] [ 1.29e-05 -3.1e-06 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.337968923264e-14 5.126965186560001e-15 -3.140266176767999e-14 ] [ 4.662333966527999e-14 -2.88391791744e-15 -5.543531107968001e-14 ] [ -1.874546646336e-14 -2.387243164992e-14 1.0077690944832e-13 ] [ 2.948004982272e-14 4.357920408576e-14 -1.84250311392e-14 ] [ -4.646312200320001e-15 -1.68228545184e-14 7.370012455680001e-15 ] [ 2.066807840832e-14 -4.96674752448e-15 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.506508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.683328148384817e-18 } }