{ "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" [ [ 1.463646 2.399639 1.70499 ] [ 1.562869 2.634357 3.942252 ] [ 0.7671946 4.252199 0.5443388 ] [ 2.243771 4.169464 2.448835 ] [ 3.362616 2.323379 2.490002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.463646e-10 2.399639e-10 1.70499e-10 ] [ 1.562869e-10 2.634357e-10 3.942252e-10 ] [ 7.671945999999999e-11 4.252199e-10 5.443388e-11 ] [ 2.243771e-10 4.169464e-10 2.448835e-10 ] [ 3.362616e-10 2.323379e-10 2.490002e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7817416 -12.4735122 -12.3712418 ] [ -6.7181321 -2.8543216 15.1436082 ] [ -2.4319403 2.8098976 -3.6183046 ] [ 3.6047953 20.1589116 1.3882526 ] [ 17.3270187 -7.6409754 -0.5423144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.887643094382679e-08 -1.998476962610358e-08 -1.982091438222371e-08 ] [ -1.076363418606601e-08 -4.573127335764449e-09 2.426273501259517e-08 ] [ -3.896397891841338e-09 4.50195224156203e-09 -5.797163037053095e-09 ] [ 5.775518752429723e-09 3.229813686629392e-08 2.224225859484814e-09 ] [ 2.776094426930441e-08 -1.224219214598793e-08 -8.688834528031795e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 3.1742275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.085673089600432e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2416773 1.7458337 1.6692496 ] [ 1.0222648 2.8923426 3.8765161 ] [ 1.0064466 4.0937026 0.8526577 ] [ 2.5183611 4.5657815 2.7829169 ] [ 3.6113469 2.4813777 1.9490775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2416773e-10 1.7458337e-10 1.6692496e-10 ] [ 1.0222648e-10 2.8923426e-10 3.8765161e-10 ] [ 1.0064466e-10 4.0937026e-10 8.526577e-11 ] [ 2.5183611e-10 4.5657815e-10 2.7829169e-10 ] [ 3.6113469e-10 2.4813777e-10 1.9490775e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.7e-06 -2.28e-05 -2e-06 ] [ 1.58e-05 5.5e-06 -9.2e-06 ] [ -9.8e-06 1.06e-05 -1.43e-05 ] [ 4.3e-06 1.51e-05 2.08e-05 ] [ -1.61e-05 -8.5e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.13240673856e-15 -3.652962695424e-14 -3.2043532416e-15 ] [ 2.531439060864e-14 8.8119714144e-15 -1.474002491136e-14 ] [ -1.570133088384e-14 1.698307218048e-14 -2.291112567744e-14 ] [ 6.889359469440001e-15 2.419286697408e-14 3.332527371264e-14 ] [ -2.579504359488e-14 -1.36185012768e-14 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }