{ "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" [ [ 1.255333 1.27162 2.732919 ] [ 0.1563082 2.037757 0.9195406 ] [ 2.732822 1.199342 1.101381 ] [ 2.723495 2.772071 2.173764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.255333e-10 1.27162e-10 2.732919e-10 ] [ 1.563082e-11 2.037757e-10 9.195406000000001e-11 ] [ 2.732822e-10 1.199342e-10 1.101381e-10 ] [ 2.723495e-10 2.772071e-10 2.173764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8467459 -3.7619096 6.3167654 ] [ -2.1670722 -0.4158615 -2.4097202 ] [ 2.4735886 -12.5339562 -12.4419399 ] [ 5.5402295 16.7117273 8.5348948 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.367519665915299e-09 -6.027243660340286e-09 1.012057392633966e-08 ] [ -3.472032443030974e-09 -6.662835782801909e-10 -3.860797398917807e-09 ] [ 3.963125857048772e-09 -2.008161175521943e-08 -1.993418538941229e-08 ] [ 8.876426251897502e-09 2.67751389938399e-08 1.36744090222081e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2016535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.527437793864319e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7915486 1.9362149 3.1328333 ] [ 0.3688849 1.2716466 0.8867853 ] [ 2.6424306 1.7041798 0.3309691 ] [ 3.0650941 2.3687487 2.5770169 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.915486000000001e-11 1.9362149e-10 3.1328333e-10 ] [ 3.688849e-11 1.2716466e-10 8.867853e-11 ] [ 2.6424306e-10 1.7041798e-10 3.309691e-11 ] [ 3.0650941e-10 2.3687487e-10 2.5770169e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 0.0 1e-07 ] [ -5e-07 -2e-07 9e-07 ] [ 1.2e-06 5e-07 -4e-07 ] [ 7e-07 -3e-07 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.0828296242e-15 0.0 1.602176634e-16 ] [ -8.010883169999999e-16 -3.204353268e-16 1.4419589706e-15 ] [ 1.9226119608e-15 8.010883169999999e-16 -6.408706536e-16 ] [ 1.1215236438e-15 -4.806529901999999e-16 -9.613059803999998e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.6379755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383956251116446e-18 } }