{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2177646 -0.4284963 -0.0524808 ] [ -2.9621848 -0.178664 2.4208729 ] [ -0.885878 -0.9460572 -0.3473935 ] [ -0.0321956 -0.3774015 -1.6654761 ] [ 3.9797713 -1.3334024 -2.2342919 ] [ 0.2086183 3.2334105 2.0427723 ] [ 0.9096333 0.0306108 -0.1640028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.951073987832356e-09 -6.865267596154541e-10 -8.408351149362719e-11 ] [ -4.745943272149963e-09 -2.862512861369759e-10 3.878665994263818e-09 ] [ -1.419333032174652e-09 -1.515750740267465e-09 -5.565857485034789e-10 ] [ -5.158303803761039e-11 -6.046638649365509e-10 -2.668386891905447e-09 ] [ 6.376296585523804e-09 -2.136346168999521e-09 -3.579730275715465e-09 ] [ 3.342433656848022e-10 5.180494751230256e-09 3.272882047642438e-09 ] [ 1.457393218768312e-09 4.90439085080472e-11 -2.627614540705752e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.93713806491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.713628685444101e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8593512 2.5510447 2.8798435 ] [ 2.5486515 0.9816256 5.6407501 ] [ 1.9484061 0.1232065 3.4915887 ] [ 3.8667651 1.2415197 1.6842568 ] [ 4.4395267 0.685093 4.0127391 ] [ 3.5649127 2.9035024 4.6883742 ] [ 4.1994938 3.4774105 2.4680406 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8593512e-10 2.5510447e-10 2.8798435e-10 ] [ 2.5486515e-10 9.816256e-11 5.6407501e-10 ] [ 1.9484061e-10 1.232065e-11 3.4915887e-10 ] [ 3.8667651e-10 1.2415197e-10 1.6842568e-10 ] [ 4.4395267e-10 6.85093e-11 4.0127391e-10 ] [ 3.5649127e-10 2.9035024e-10 4.6883742e-10 ] [ 4.1994938e-10 3.4774105e-10 2.4680406e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.07e-05 2.48e-05 -2.2e-05 ] [ 2.36e-05 3.54e-05 8.1e-06 ] [ 2.99e-05 -3.32e-05 -1.68e-05 ] [ 5.4e-06 2.17e-05 2.78e-05 ] [ -5.7e-05 -4.71e-05 1.87e-05 ] [ 1.9e-05 -2.85e-05 1.15e-05 ] [ -4.16e-05 2.7e-05 -2.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.316505632379999e-14 3.97339805232e-14 -3.5247885948e-14 ] [ 3.78113685624e-14 5.671705284359999e-14 1.29776307354e-14 ] [ 4.790508135659999e-14 -5.31922642488e-14 -2.691656745119999e-14 ] [ 8.6517538236e-15 3.476723295779999e-14 4.454051042519999e-14 ] [ -9.132406813799999e-14 -7.546251946139999e-14 2.99607030558e-14 ] [ 3.0441356046e-14 -4.5662034069e-14 1.8425031291e-14 ] [ -6.665054797439999e-14 4.325876911799999e-14 -4.389963977159999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }