{ "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" [ [ 1.040169 0.3467498 1.049872 ] [ 0.0600036 1.405044 1.572488 ] [ 2.420904 2.65585 0.1683769 ] [ 1.553585 1.595169 0.3590691 ] [ 2.059971 2.654503 2.612695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.040169e-10 3.467498e-11 1.049872e-10 ] [ 6.00036e-12 1.405044e-10 1.572488e-10 ] [ 2.420904e-10 2.65585e-10 1.683769e-11 ] [ 1.553585e-10 1.595169e-10 3.590691e-11 ] [ 2.059971e-10 2.654503e-10 2.612695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.4147526 -82.3275367 7.7590266 ] [ -43.8623539 36.2106295 27.3197406 ] [ 53.6845227 66.2081301 -10.6377311 ] [ -24.6956733 -19.8063119 -24.4061342 ] [ -0.5412481 -0.2849109 -0.0349019 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.469715643461075e-08 -1.319032556355175e-07 1.243133112110446e-08 ] [ -7.027523853081877e-08 5.80158244873311e-08 4.377105003626113e-08 ] [ 8.601208787738258e-08 1.060771190270521e-07 -1.704352420719512e-08 ] [ -3.956683072215766e-08 -3.173321013189614e-08 -3.910293794150828e-08 ] [ -8.671750590168953e-10 -4.564775867519106e-10 -5.591900866220459e-11 ] ] } "unrelaxed-potential-energy" { "source-value" 44.449744 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.12163412240817e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0246923 -0.4388777 0.9118038 ] [ 0.1831323 1.2891922 2.2988159 ] [ 3.2583581 2.7793998 0.4612689 ] [ 1.1298444 1.7854404 0.0651979 ] [ 1.5386055 3.2421612 2.0254145 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0246923e-10 -4.388777e-11 9.118038000000001e-11 ] [ 1.831323e-11 1.2891922e-10 2.2988159e-10 ] [ 3.2583581e-10 2.7793998e-10 4.612689e-11 ] [ 1.1298444e-10 1.7854404e-10 6.51979e-12 ] [ 1.5386055e-10 3.2421612e-10 2.0254145e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 -8.1e-06 5.2e-06 ] [ 5.8e-06 -2.6e-06 -7.5e-06 ] [ -3.3e-06 -4.3e-06 -2.6e-06 ] [ 3.4e-06 8.2e-06 -1.4e-06 ] [ -2.8e-06 6.7e-06 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.9667475654e-15 -1.29776307354e-14 8.331318496799998e-15 ] [ 9.2926244772e-15 -4.165659248399999e-15 -1.2016324755e-14 ] [ -5.2871828922e-15 -6.8893595262e-15 -4.165659248399999e-15 ] [ 5.4474005556e-15 1.31378483988e-14 -2.2430472876e-15 ] [ -4.486094575199999e-15 1.07345834478e-14 1.02539304576e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.061588 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252914773053479e-18 } }