{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8434901 -4.5091992 -7.031313 ] [ -2.6975273 -5.5765396 10.2536736 ] [ -13.2621625 2.1364347 -5.126176 ] [ -2.2338321 0.3566303 -14.4122637 ] [ 9.5356506 -2.0842965 11.6987543 ] [ 3.891323 2.3957951 -6.7878585 ] [ 8.6100384 7.2811752 11.4051832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.157950031230323e-09 -7.224533596291492e-09 -1.126540539494044e-08 ] [ -4.321915209637107e-09 -8.934601445695704e-09 1.642819625458266e-08 ] [ -2.124832687381102e-08 3.4229457564068e-09 -8.213039408971583e-09 ] [ -3.578993594899151e-09 5.713847336364102e-10 -2.309099214318639e-08 ] [ 1.527779658130808e-08 -3.339411150627981e-09 1.874347078636702e-08 ] [ 6.234586785946781e-09 3.838486929071693e-09 -1.087534828359829e-08 ] [ 1.379480234232274e-08 1.166572877350028e-08 1.827311802952934e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.95341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.556018073462194e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9498647 1.5910783 2.6810555 ] [ 3.0637158 1.9627032 4.9136317 ] [ 1.2663164 4.0157592 2.4922755 ] [ 4.247535 2.049831 1.7464863 ] [ 5.3157872 1.4483105 3.9352467 ] [ 3.8221317 4.4997624 2.0665232 ] [ 2.9081493 4.4324973 4.5117882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9498647e-10 1.5910783e-10 2.6810555e-10 ] [ 3.063715800000001e-10 1.9627032e-10 4.9136317e-10 ] [ 1.2663164e-10 4.0157592e-10 2.4922755e-10 ] [ 4.247535e-10 2.049831e-10 1.7464863e-10 ] [ 5.3157872e-10 1.4483105e-10 3.9352467e-10 ] [ 3.8221317e-10 4.4997624e-10 2.0665232e-10 ] [ 2.9081493e-10 4.4324973e-10 4.5117882e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-06 1.35e-05 1.08e-05 ] [ 7e-06 -6e-07 -4.7e-06 ] [ -2.13e-05 9.1e-06 -1.26e-05 ] [ 2.2e-06 -8.5e-06 4e-06 ] [ 9.6e-06 -8.4e-06 4.1e-06 ] [ 5e-07 8.3e-06 2.5e-06 ] [ -1.4e-06 -1.33e-05 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.4474005556e-15 2.162938455899999e-14 1.73035076472e-14 ] [ 1.1215236438e-14 -9.613059803999998e-16 -7.530230179799999e-15 ] [ -3.41263623042e-14 1.45798073694e-14 -2.01874255884e-14 ] [ 3.5247885948e-15 -1.3618501389e-14 6.408706535999999e-15 ] [ 1.53808956864e-14 -1.34582837256e-14 6.568924199399999e-15 ] [ 8.010883169999999e-16 1.32980660622e-14 4.005441585e-15 ] [ -2.2430472876e-15 -2.13089492322e-14 -6.408706535999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.70934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.798655055556156e-18 } }