{ "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" [ [ 0.0795215 1.172985 2.972487 ] [ 0.7048054 0.2310616 1.565444 ] [ 0.5328429 2.146868 1.561816 ] [ 2.937455 0.8293126 0.8336996 ] [ 1.506301 0.8690976 0.2004578 ] [ 2.979161 2.931887 0.4386378 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.95215e-12 1.172985e-10 2.972487e-10 ] [ 7.048054e-11 2.310616e-11 1.565444e-10 ] [ 5.328429e-11 2.146868e-10 1.561816e-10 ] [ 2.937455e-10 8.293126e-11 8.336996000000001e-11 ] [ 1.506301e-10 8.690976e-11 2.004578e-11 ] [ 2.979161e-10 2.931887e-10 4.386378e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7040024 -1.7249196 29.9729806 ] [ -23.4601175 -37.3813061 12.2176077 ] [ -0.1154651 28.8766265 -11.9793175 ] [ 52.3939964 3.1001336 6.7038522 ] [ -18.3708414 5.0771299 -37.0204607 ] [ 1.2564301 2.0523358 0.1053378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.875187901506709e-08 -2.763625855879688e-09 4.802200877301196e-08 ] [ -3.758725177972095e-08 -5.989145468838844e-08 1.957476541904606e-08 ] [ -1.849954837383341e-10 4.626545586587373e-08 -1.919298243164031e-08 ] [ 8.394443610235936e-08 4.966961575276539e-09 1.074075526413865e-08 ] [ -2.943333259550474e-08 8.134458826544642e-09 -5.93133166247852e-08 ] [ 2.013022931889406e-09 3.288204436790864e-09 1.687697604465062e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 19.205054 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.076988852000153e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0217258 1.2181058 3.1490865 ] [ 0.5492427 -0.3379517 1.6655537 ] [ 0.5636173 2.4864403 1.4179336 ] [ 3.4512258 0.8853921 0.9316553 ] [ 1.1345845 0.9303828 -0.0655997 ] [ 3.0631422 2.9988425 0.4739128 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.17258e-12 1.2181058e-10 3.1490865e-10 ] [ 5.492427e-11 -3.379517000000001e-11 1.6655537e-10 ] [ 5.636173e-11 2.4864403e-10 1.4179336e-10 ] [ 3.4512258e-10 8.853921000000001e-11 9.316553e-11 ] [ 1.1345845e-10 9.303828e-11 -6.55997e-12 ] [ 3.0631422e-10 2.9988425e-10 4.739128000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 2e-07 7.7e-06 ] [ -5e-07 1.15e-05 -1.6e-06 ] [ -1e-06 -9.6e-06 1.4e-06 ] [ 0.0 -1e-07 0.0 ] [ 3.5e-06 -2.1e-06 -7.5e-06 ] [ -0.0 1e-07 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 3.2043532416e-16 1.233675998016e-14 ] [ -8.010883104e-16 1.84250311392e-14 -2.56348259328e-15 ] [ -1.6021766208e-15 -1.538089555968e-14 2.24304726912e-15 ] [ 0.0 -1.6021766208e-16 0.0 ] [ 5.6076181728e-15 -3.36457090368e-15 -1.2016324656e-14 ] [ 0.0 1.6021766208e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -10.436696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672143032959688e-18 } }