{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4467949 -15.5420014 2.4367292 ] [ -31.9870109 -20.6846767 -27.9367974 ] [ -10.5086896 4.2800532 37.1166718 ] [ 2.044059 -0.0030854 -1.9239396 ] [ 9.5956619 6.0947699 2.561785 ] [ 37.3027745 25.8549403 -12.254449 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.032890406787267e-08 -2.490103128352087e-08 3.904070555460687e-09 ] [ -5.124884103325477e-08 -3.31405054175465e-08 -4.475968365430623e-08 ] [ -1.68367767923641e-08 6.857401172820228e-09 5.946746379986665e-08 ] [ 3.274943541335827e-09 -4.94335574581632e-12 -3.082491046951304e-09 ] [ 1.537394515728131e-08 9.764897842935555e-09 4.104432034516128e-09 ] [ 5.976563319487441e-08 4.142418088083974e-08 -1.963379168858594e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 25.74645782091806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.125037278908823e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7104109 -0.1857174 2.0443845 ] [ 0.0499627 1.5258242 0.4565739 ] [ 0.6407077 2.1412227 2.7279167 ] [ 2.1836837 0.3980878 0.2071789 ] [ 2.7744185 1.0134922 2.4785214 ] [ 2.1139688 2.7250248 0.8906933 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.104109e-11 -1.857174e-11 2.0443845e-10 ] [ 4.99627e-12 1.5258242e-10 4.565739e-11 ] [ 6.407077e-11 2.1412227e-10 2.7279167e-10 ] [ 2.1836837e-10 3.980878e-11 2.071789e-11 ] [ 2.7744185e-10 1.0134922e-10 2.4785214e-10 ] [ 2.1139688e-10 2.7250248e-10 8.906933000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 2.62e-05 1.35e-05 ] [ 1.56e-05 -3.66e-05 -2.4e-06 ] [ 6.1e-06 -2.05e-05 -1.7e-05 ] [ -3.14e-05 8e-06 -8.9e-06 ] [ -1.69e-05 1.18e-05 -1.6e-05 ] [ 2.58e-05 1.1e-05 3.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 4.197702746496e-14 2.16293843808e-14 ] [ 2.499395528448e-14 -5.863966432128e-14 -3.84522388992e-15 ] [ 9.77327738688e-15 -3.28446207264e-14 -2.72370025536e-14 ] [ -5.030834589312e-14 1.28174129664e-14 -1.425937192512e-14 ] [ -2.707678489152e-14 1.890568412544e-14 -2.56348259328e-14 ] [ 4.133615681664e-14 1.76239428288e-14 4.950725758272e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }