{ "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" [ [ 1.344878 2.219137 2.797465 ] [ 2.001288 4.461966 3.139291 ] [ 3.23388 2.535754 1.187329 ] [ 4.3257 4.424828 2.075195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.344878e-10 2.219137e-10 2.797465e-10 ] [ 2.001288e-10 4.461966000000001e-10 3.139291e-10 ] [ 3.23388e-10 2.535754e-10 1.187329e-10 ] [ 4.3257e-10 4.424828e-10 2.075195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3013001 0.9065008 -0.8659399 ] [ 1.360189 -0.7973663 -0.8305316 ] [ -0.8029482 0.4160144 1.2928305 ] [ -1.8585408 -0.5251489 0.4036409 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.084912596864702e-09 1.452374388496497e-09 -1.38738866279789e-09 ] [ 2.179263015669331e-09 -1.277521644073799e-09 -1.330658312355617e-09 ] [ -1.286464833753443e-09 6.665285455961396e-10 2.071342801757174e-09 ] [ -2.977710618562929e-09 -8.413812900188372e-10 6.467040131786708e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8746222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.412182344872662e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4791738 2.4448235 2.5790203 ] [ 2.1281789 4.4811224 3.3301975 ] [ 3.3246869 2.3397265 1.2694319 ] [ 3.9737064 4.3760126 2.0206303 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4791738e-10 2.4448235e-10 2.5790203e-10 ] [ 2.1281789e-10 4.481122400000001e-10 3.3301975e-10 ] [ 3.3246869e-10 2.3397265e-10 1.2694319e-10 ] [ 3.973706400000001e-10 4.3760126e-10 2.0206303e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 4.9e-06 -2.4e-06 ] [ -3e-07 -1.4e-06 6.7e-06 ] [ 5.7e-06 -5.9e-06 -0.0 ] [ -2.4e-06 2.4e-06 -4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 7.850665441919999e-15 -3.84522388992e-15 ] [ -4.8065298624e-16 -2.24304726912e-15 1.073458335936e-14 ] [ 9.13240673856e-15 -9.45284206272e-15 0.0 ] [ -3.84522388992e-15 3.84522388992e-15 -6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }