{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.9721756 -5.8481863 14.9452981 ] [ -1.5946098 0.4260297 2.0815702 ] [ 8.7017793 -27.8994426 6.0664491 ] [ 108.2142271 21.213804 31.2541601 ] [ -102.3492209 12.1077953 -54.3474775 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.078371646723221e-08 -9.369827363942855e-09 2.394500720670666e-08 ] [ -2.554846540858564e-09 6.825748251064377e-10 3.33504310899398e-09 ] [ 1.394178735382139e-08 -4.469983466707156e-08 9.719522919293202e-09 ] [ 1.733783046975618e-07 3.398826080703353e-08 5.00746846149602e-08 ] [ -1.639815288830748e-07 1.939882655909212e-08 -8.707425784995403e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.3541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.542827612382528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0604397 0.3730417 3.0480791 ] [ -0.0995289 1.9929818 1.9627711 ] [ 3.0913295 0.1800958 2.0551606 ] [ 3.186519 1.6807858 0.356191 ] [ 1.2144637 2.8012168 0.2990975 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0604397e-10 3.730417e-11 3.0480791e-10 ] [ -9.952890000000001e-12 1.9929818e-10 1.9627711e-10 ] [ 3.0913295e-10 1.800958e-11 2.0551606e-10 ] [ 3.186519e-10 1.6807858e-10 3.56191e-11 ] [ 1.2144637e-10 2.801216800000001e-10 2.990975e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 -3.8e-06 3.2e-06 ] [ 7.1e-06 3.1e-06 -6.9e-06 ] [ -2e-07 1.9e-06 -2.7e-06 ] [ -1e-06 -4.2e-06 6.4e-06 ] [ -7.6e-06 3e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 -6.08827115904e-15 5.126965186560001e-15 ] [ 1.137545400768e-14 4.96674752448e-15 -1.105501868352e-14 ] [ -3.2043532416e-16 3.04413557952e-15 -4.32587687616e-15 ] [ -1.6021766208e-15 -6.72914180736e-15 1.025393037312e-14 ] [ -1.217654231808e-14 4.8065298624e-15 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.332164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.296265808627141e-18 } }