{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.0017061 -22.3877242 -5.0705725 ] [ 0.3182865 -0.0301833 -1.6444096 ] [ 57.8817114 -118.3093204 -28.0485123 ] [ -58.0815004 73.5644276 -60.9089989 ] [ 14.8832086 67.1628003 95.6724932 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.403538278553275e-08 -3.586908830615839e-08 -8.123952713571407e-09 ] [ 5.099511890162592e-10 -4.835897759859264e-11 -2.634634616139079e-09 ] [ 9.273672477697285e-08 -1.895524271676165e-07 -4.493867065528124e-08 ] [ -9.305682204186586e-08 1.178632060232543e-07 -9.758697403391292e-08 ] [ 2.38455288614095e-08 1.076066684281192e-07 1.53284231858687e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 21.288685 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.410823339457565e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8363227 0.4036699 0.4490148 ] [ -0.7315205 -0.4051704 2.2114322 ] [ 3.2222485 0.8522477 1.3834109 ] [ 1.4908932 2.8991039 0.7826686 ] [ 3.5461628 3.2498919 2.3368623 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.363227e-11 4.036699000000001e-11 4.490148e-11 ] [ -7.315205000000001e-11 -4.051704e-11 2.2114322e-10 ] [ 3.2222485e-10 8.522477e-11 1.3834109e-10 ] [ 1.4908932e-10 2.8991039e-10 7.826686e-11 ] [ 3.5461628e-10 3.2498919e-10 2.3368623e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.4e-06 3.37e-05 -3.8e-05 ] [ -3.2e-05 -2.34e-05 3.27e-05 ] [ 1.28e-05 -2.9e-06 4.6e-06 ] [ 1.61e-05 -2.15e-05 6.1e-06 ] [ -6.2e-06 1.42e-05 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.506046023552e-14 5.399335212096e-14 -6.08827115904e-14 ] [ -5.12696518656e-14 -3.749093292672001e-14 5.239117550016001e-14 ] [ 2.050786074624e-14 -4.646312200320001e-15 7.370012455680001e-15 ] [ 2.579504359488e-14 -3.44467973472e-14 9.77327738688e-15 ] [ -9.93349504896e-15 2.275090801536e-14 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.770627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.526732987475724e-18 } }