{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5380398 -0.9879027 0.9969235 ] [ 0.738201 -0.492445 0.3769832 ] [ 5.3494499 -13.0091737 11.4716746 ] [ -3.4197789 13.5199256 -11.838482 ] [ -0.1298322 0.9695957 -1.0070993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.066388030219908e-09 -1.582794609565196e-09 1.597247524426109e-09 ] [ 1.182728383651181e-09 -7.88983866029856e-10 6.039936694743706e-10 ] [ 8.570763563920897e-09 -2.084299395806623e-08 1.837964884554519e-08 ] [ -5.479089801885141e-09 2.166130871127542e-08 -1.896733908616163e-08 ] [ -2.080141154670298e-10 1.55346356216821e-09 -1.613550953284045e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.5304843992349504 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.49929702153371e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.5037222 0.3801236 2.0786135 ] [ 0.5479279 2.6458127 1.3299038 ] [ 2.3728546 0.0202363 3.3583431 ] [ 2.5161252 1.4283691 1.5657679 ] [ 2.2458428 2.8540787 -0.1980353 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.037222e-11 3.801236000000001e-11 2.0786135e-10 ] [ 5.479279000000001e-11 2.6458127e-10 1.3299038e-10 ] [ 2.3728546e-10 2.02363e-12 3.3583431e-10 ] [ 2.5161252e-10 1.4283691e-10 1.5657679e-10 ] [ 2.2458428e-10 2.8540787e-10 -1.980353e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.11e-05 4.2e-06 1.89e-05 ] [ 2.6e-06 -8.8e-06 -2.25e-05 ] [ 1.35e-05 -1.65e-05 7.9e-06 ] [ -1.46e-05 1.53e-05 -2.05e-05 ] [ 9.7e-06 5.7e-06 1.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.778416049088e-14 6.72914180736e-15 3.028113813312e-14 ] [ 4.16565921408e-15 -1.409915426304e-14 -3.604897396800001e-14 ] [ 2.16293843808e-14 -2.64359142432e-14 1.265719530432e-14 ] [ -2.339177866368e-14 2.451330229824e-14 -3.28446207264e-14 ] [ 1.554111322176e-14 9.13240673856e-15 2.595526125696e-14 ] ] } "relaxed-potential-energy" { "source-value" -4.99599539923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.004467026278599e-19 } }