{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5276736 -1.6025574 0.0764554 ] [ -0.8941682 -1.429132 -1.2985936 ] [ -2.9384497 1.9608433 1.4604458 ] [ 0.302423 1.0181624 0.5734356 ] [ -0.5186835 0.6552942 -0.1599848 ] [ 3.3047046 -1.8085952 1.1350251 ] [ 0.2165004 1.2059847 -1.7867835 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.454263053333709e-10 -2.567579999770034e-09 1.224950544139123e-10 ] [ -1.432615385102819e-09 -2.289721878437146e-09 -2.080576305840507e-09 ] [ -4.707915410736774e-09 3.141617292312321e-09 2.339892116705553e-09 ] [ 4.845350601921984e-10 1.631275993457618e-09 9.187451118544205e-10 ] [ -8.310225772947167e-10 1.049897046985839e-09 -2.563239062433638e-10 ] [ 5.294720448770216e-09 -2.8976889459311e-09 1.818510679241182e-09 ] [ 3.468718792738483e-10 1.932200491382502e-09 -2.862742750131197e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.701913158928928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.07376485778678e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8940563 1.6101832 2.0696356 ] [ 2.5339242 0.3169058 4.0228574 ] [ 2.341489 2.5473344 4.9637126 ] [ 1.4286956 3.7319695 3.0878698 ] [ 4.1832535 0.921194 2.2829546 ] [ 4.5364229 1.6609213 4.5672834 ] [ 3.7366435 3.2674506 2.8814786 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8940563e-10 1.6101832e-10 2.0696356e-10 ] [ 2.5339242e-10 3.169058e-11 4.022857400000001e-10 ] [ 2.341489e-10 2.5473344e-10 4.9637126e-10 ] [ 1.4286956e-10 3.7319695e-10 3.0878698e-10 ] [ 4.1832535e-10 9.21194e-11 2.2829546e-10 ] [ 4.5364229e-10 1.6609213e-10 4.5672834e-10 ] [ 3.7366435e-10 3.2674506e-10 2.8814786e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.03e-05 1.45e-05 3.21e-05 ] [ -1.05e-05 -4.99e-05 9.9e-06 ] [ -1.89e-05 2.12e-05 -1.43e-05 ] [ -4.05e-05 2.2e-05 -3.4e-06 ] [ -1.9e-06 1.61e-05 -3.92e-05 ] [ 3.46e-05 -2.37e-05 5.5e-05 ] [ 1.7e-05 -1e-07 -4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.252418540224e-14 2.32315610016e-14 5.142986952768e-14 ] [ -1.68228545184e-14 -7.994861337792e-14 1.586154854592e-14 ] [ -3.028113813312e-14 3.396614436096001e-14 -2.291112567744e-14 ] [ -6.488815314240001e-14 3.52478856576e-14 -5.44740051072e-15 ] [ -3.04413557952e-15 2.579504359488e-14 -6.280532353535999e-14 ] [ 5.543531107968001e-14 -3.797158591296e-14 8.8119714144e-14 ] [ 2.72370025536e-14 -1.6021766208e-16 -6.4087064832e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }