{ "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" [ [ 2.360944 2.643853 2.165766 ] [ 2.694587 4.80447 3.102481 ] [ 4.665525 1.923814 2.374826 ] [ 4.545146 3.928705 1.722535 ] [ 3.943017 3.203445 4.218269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.360944e-10 2.643853e-10 2.165766e-10 ] [ 2.694587e-10 4.80447e-10 3.102481e-10 ] [ 4.665525e-10 1.923814e-10 2.374826e-10 ] [ 4.545146e-10 3.928705e-10 1.722535e-10 ] [ 3.943017e-10 3.203445e-10 4.218269e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7553505 -1.797007 -1.4620145 ] [ -0.8680247 1.6801534 0.1941575 ] [ 1.4330013 -3.6213715 0.2413971 ] [ 2.3828626 4.1141423 -3.5827548 ] [ 0.8075113 -0.375917 4.6092147 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.016734774009591e-09 -2.879122602813946e-09 -2.342405451170601e-09 ] [ -1.390728880616934e-09 2.691902496837631e-09 3.11074607252976e-10 ] [ 2.295921180436007e-09 -5.802076752531428e-09 3.867607899489197e-10 ] [ 3.817766748298703e-09 6.59158260770434e-09 -5.74020597861898e-09 ] [ 1.293775725891815e-09 -6.022854287612737e-10 7.384776032587685e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2408338 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.160109462945842e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1910564 2.5084703 2.1049972 ] [ 2.8182609 4.5941176 2.9947895 ] [ 4.4654279 2.0075974 2.4387626 ] [ 4.6845236 4.201242 1.6172018 ] [ 4.0499503 3.1928596 4.4281259 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1910564e-10 2.5084703e-10 2.1049972e-10 ] [ 2.8182609e-10 4.5941176e-10 2.9947895e-10 ] [ 4.4654279e-10 2.0075974e-10 2.4387626e-10 ] [ 4.6845236e-10 4.201242e-10 1.6172018e-10 ] [ 4.0499503e-10 3.1928596e-10 4.428125900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 2.2e-06 8e-07 ] [ -4.9e-06 1.3e-06 -1e-07 ] [ 2.5e-06 3e-07 -5.1e-06 ] [ 1e-06 -5.6e-06 2.7e-06 ] [ 9e-07 1.8e-06 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-16 3.52478856576e-15 1.28174129664e-15 ] [ -7.850665441919999e-15 2.08282960704e-15 -1.6021766208e-16 ] [ 4.005441552e-15 4.8065298624e-16 -8.17110076608e-15 ] [ 1.6021766208e-15 -8.972189076479999e-15 4.32587687616e-15 ] [ 1.44195895872e-15 2.88391791744e-15 2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }