{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.683384 0.6467413 1.642761 ] [ 3.245791 2.703982 2.222722 ] [ 3.737288 4.91418 2.043298 ] [ 4.142825 3.455017 4.506693 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.683384e-10 6.467413e-11 1.642761e-10 ] [ 3.245791e-10 2.703982e-10 2.222722e-10 ] [ 3.737288e-10 4.91418e-10 2.043298e-10 ] [ 4.142825e-10 3.455017e-10 4.506693e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3656681 -1.2607621 -0.5015316 ] [ 0.6116529 0.7384548 1.7800428 ] [ 0.2536531 0.5916688 0.2707367 ] [ -0.499638 -0.0693615 -1.5492479 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.858648856191753e-10 -2.019963577652771e-09 -8.035422107326343e-10 ] [ 9.799759844983387e-10 1.183135025825143e-09 2.851942981679935e-09 ] [ 4.063970699616654e-10 9.479579264268192e-10 4.337680147062678e-10 ] [ -8.005083290584919e-10 -1.11129374599191e-10 -2.482168785653568e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.681727 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.070530687416692e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9434519 0.6576598 1.4690724 ] [ 2.6969419 2.665537 2.5532697 ] [ 3.9556423 4.7768984 2.0958653 ] [ 4.2132519 3.6198251 4.2972666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9434519e-10 6.576598e-11 1.4690724e-10 ] [ 2.6969419e-10 2.665537e-10 2.5532697e-10 ] [ 3.9556423e-10 4.7768984e-10 2.0958653e-10 ] [ 4.213251900000001e-10 3.6198251e-10 4.2972666e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.1e-06 -5.9e-06 -7.1e-06 ] [ 1.67e-05 3.4e-06 4.1e-06 ] [ -5.3e-06 2.3e-06 -9.6e-06 ] [ -3.4e-06 3e-07 1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.29776307354e-14 -9.452842140600001e-15 -1.13754541014e-14 ] [ 2.67563497878e-14 5.4474005556e-15 6.568924199399999e-15 ] [ -8.4915361602e-15 3.685006258199999e-15 -1.53808956864e-14 ] [ -5.4474005556e-15 4.806529901999999e-16 2.01874255884e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.19765907744768e-18 } }