{ "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" [ [ 2.264039 2.962814 1.145416 ] [ 2.607686 1.947625 3.138097 ] [ 3.569117 1.227918 0.4731936 ] [ 5.155867 2.512325 3.932817 ] [ 4.543954 3.206398 1.939601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.264039e-10 2.962814e-10 1.145416e-10 ] [ 2.607686e-10 1.947625e-10 3.138097e-10 ] [ 3.569117e-10 1.227918e-10 4.731936e-11 ] [ 5.155867e-10 2.512325e-10 3.932817e-10 ] [ 4.543954e-10 3.206398e-10 1.939601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5951781 0.9210055 -0.5720094 ] [ 1.2895421 -0.2223379 0.7385677 ] [ 0.4933761 0.0716894 0.3342793 ] [ -0.5269949 -0.5710498 1.13756 ] [ -0.6607452 -0.1993072 -1.6383976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.535804370321645e-10 1.475613479728215e-09 -9.164600875578355e-10 ] [ 2.066074204157336e-09 -3.562245852977684e-10 1.183315901818028e-09 ] [ 7.904756526814829e-10 1.148590806391795e-10 5.355744792773894e-10 ] [ -8.44338908060834e-10 -9.14922638872516e-10 1.822572036757248e-09 ] [ -1.05863051174582e-09 -3.193253361971097e-10 -2.625002330294831e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.06118139923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.506729890682069e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2810662 3.1709305 1.2648967 ] [ 2.9208918 1.6749628 2.9903822 ] [ 3.4955068 1.2682784 0.7256427 ] [ 4.8289064 2.6178075 3.9607226 ] [ 4.6142917 3.1251008 1.6874805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2810662e-10 3.1709305e-10 1.2648967e-10 ] [ 2.9208918e-10 1.6749628e-10 2.9903822e-10 ] [ 3.4955068e-10 1.2682784e-10 7.256427e-11 ] [ 4.8289064e-10 2.6178075e-10 3.9607226e-10 ] [ 4.6142917e-10 3.1251008e-10 1.6874805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.29e-05 8.8e-06 6.6e-06 ] [ -6.6e-06 -2.3e-05 -5e-07 ] [ 1.3e-06 1.5e-06 3.05e-05 ] [ -1.49e-05 -3.9e-06 -2.25e-05 ] [ -2.7e-06 1.66e-05 -1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.668984461632e-14 1.409915426304e-14 1.057436569728e-14 ] [ -1.057436569728e-14 -3.68500622784e-14 -8.010883104e-16 ] [ 2.08282960704e-15 2.4032649312e-15 4.88663869344e-14 ] [ -2.387243164992e-14 -6.24848882112e-15 -3.604897396800001e-14 ] [ -4.32587687616e-15 2.659613190528e-14 -2.227025502912e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.057896399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.103643361282738e-19 } }