{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0483523 -1.9171505 -0.862341 ] [ -2.5310714 -2.9792485 4.8197687 ] [ -3.7493675 3.2105293 -2.6520148 ] [ 3.5807242 -0.9364908 -3.6218656 ] [ 1.8025408 -0.9196942 0.972721 ] [ -0.1126086 -0.5131446 0.439052 ] [ 1.0581347 4.0551993 0.9046797 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.746892462190784e-11 -3.07161370965503e-09 -1.381622589357293e-09 ] [ -4.055223422655526e-09 -4.773282294253469e-09 7.722120728803609e-09 ] [ -6.007148951287344e-09 5.14383498485339e-09 -4.248996110575588e-09 ] [ 5.736952598772783e-09 -1.500423665354289e-09 -5.802868387999765e-09 ] [ 2.887988727798129e-09 -1.473512545525359e-09 1.558470844761197e-09 ] [ -1.804188662210189e-10 -8.221482812097676e-10 7.034388497154817e-10 ] [ 1.695318677997222e-09 6.497145511144526e-09 1.449456664652358e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.98338 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.560819775736231e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0712978 1.4584693 1.8217339 ] [ 2.3735919 2.2809797 4.0059513 ] [ 1.6649157 4.5928195 3.7104737 ] [ 5.2275727 2.5665532 2.0599892 ] [ 4.6732149 3.0707131 4.4077303 ] [ 4.8929927 4.9158229 1.5094369 ] [ 3.9841702 5.3376643 3.7298406 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0712978e-10 1.4584693e-10 1.8217339e-10 ] [ 2.3735919e-10 2.2809797e-10 4.005951300000001e-10 ] [ 1.6649157e-10 4.5928195e-10 3.7104737e-10 ] [ 5.2275727e-10 2.5665532e-10 2.0599892e-10 ] [ 4.6732149e-10 3.0707131e-10 4.4077303e-10 ] [ 4.8929927e-10 4.9158229e-10 1.5094369e-10 ] [ 3.9841702e-10 5.3376643e-10 3.7298406e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.08e-05 1.79e-05 1.35e-05 ] [ 0.0 7.8e-06 -9.1e-06 ] [ 1.9e-06 -1.66e-05 -5.9e-06 ] [ -2.48e-05 -2.05e-05 4.4e-06 ] [ -2.6e-06 2.4e-06 -5.3e-06 ] [ 3.7e-06 5.5e-06 -2.91e-05 ] [ 1e-06 3.5e-06 3.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.332527371264e-14 2.867896151232001e-14 2.16293843808e-14 ] [ 0.0 1.249697764224e-14 -1.457980724928e-14 ] [ 3.04413557952e-15 -2.659613190528e-14 -9.45284206272e-15 ] [ -3.973398019584e-14 -3.28446207264e-14 7.04957713152e-15 ] [ -4.16565921408e-15 3.84522388992e-15 -8.491536090240001e-15 ] [ 5.928053496960001e-15 8.8119714144e-15 -4.662333966527999e-14 ] [ 1.6021766208e-15 5.6076181728e-15 5.04685635552e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.146068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.387973577144701e-18 } }