{ "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" [ [ -5.958369 -4.6998832 4.3718284 ] [ -9.0533886 2.5148398 -1.1670124 ] [ 0.3120299 -3.1755035 2.1173316 ] [ 7.4047378 0.8705411 1.0674942 ] [ 7.2949899 4.4900058 -6.3896419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.546359588549945e-09 -7.530043045569149e-09 7.004441310337605e-09 ] [ -1.450512767344197e-08 4.029217565813232e-09 -1.869759998868261e-09 ] [ 4.999270148893566e-10 -5.087717508885218e-09 3.392339215949834e-09 ] [ 1.186369788405656e-08 1.394760609356657e-09 1.710314264170523e-09 ] [ 1.168786236304599e-08 7.193782379284477e-09 -1.023733495180736e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.5934053 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.15509337415176e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0504382 -0.1332972 2.3920237 ] [ -0.0502056 2.3748335 1.529104 ] [ 2.4521979 0.3666432 2.6014237 ] [ 2.4507652 2.3055395 1.9463599 ] [ 3.2832768 2.4149015 -0.3343184 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.04382e-12 -1.332972e-11 2.3920237e-10 ] [ -5.02056e-12 2.3748335e-10 1.529104e-10 ] [ 2.4521979e-10 3.666432e-11 2.6014237e-10 ] [ 2.450765200000001e-10 2.3055395e-10 1.9463599e-10 ] [ 3.2832768e-10 2.4149015e-10 -3.343184e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 -3.6e-06 5.9e-06 ] [ -9.7e-06 1.17e-05 -8.8e-06 ] [ 1.4e-06 6.9e-06 -8.8e-06 ] [ -1.5e-06 -1.34e-05 1.68e-05 ] [ 2e-06 -1.6e-06 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.23367600818e-14 -5.767835882399999e-15 9.452842140600001e-15 ] [ -1.55411133498e-14 1.87454666178e-14 -1.40991543792e-14 ] [ 2.2430472876e-15 1.10550187746e-14 -1.40991543792e-14 ] [ -2.403264951e-15 -2.14691668956e-14 2.691656745119999e-14 ] [ 3.204353268e-15 -2.5634826144e-15 -8.010883169999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.505456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.843377276671511e-18 } }