{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.0391347 -50.0730241 -27.5627662 ] [ -35.9429591 -42.3027658 49.1173737 ] [ 35.6248618 42.0496611 36.9578138 ] [ -42.5096299 31.5230326 -22.0428417 ] [ 36.2109014 -19.5953238 -15.6826392 ] [ 26.6559605 38.39842 -20.7869404 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.210623311740202e-08 -8.022582854577496e-08 -4.416041961021646e-08 ] [ -5.758696875239062e-08 -6.777650235993782e-08 7.86947078172368e-08 ] [ 5.7077320695191e-08 6.737098392698322e-08 5.92129452262396e-08 ] [ -6.810793518464064e-08 5.050546584843624e-08 -3.531652562773533e-08 ] [ 5.801625964117399e-08 -3.139516966936581e-08 -2.512635787868162e-08 ] [ 4.270755671806828e-08 6.152105079965914e-08 -3.3304349926843e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 59.8566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.590084512057728e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3788376 -0.0809222 0.3440898 ] [ 0.5186023 0.2324042 2.7077047 ] [ 1.7726765 2.2627645 2.8688003 ] [ -0.1507314 2.288867 -0.2438393 ] [ 2.7549067 0.4888983 -0.1770677 ] [ 2.1555694 2.7956706 0.5723283 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.788376e-11 -8.09222e-12 3.440898e-11 ] [ 5.186023e-11 2.324042e-11 2.7077047e-10 ] [ 1.7726765e-10 2.2627645e-10 2.8688003e-10 ] [ -1.507314e-11 2.288867e-10 -2.438393e-11 ] [ 2.7549067e-10 4.888983e-11 -1.770677e-11 ] [ 2.1555694e-10 2.7956706e-10 5.723283e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.97e-05 -4.76e-05 8.4e-06 ] [ 1.64e-05 -6.9e-06 -1.29e-05 ] [ -5.8e-06 4.9e-06 -2.1e-06 ] [ -1.39e-05 1.15e-05 -1.12e-05 ] [ 1.06e-05 -1.58e-05 2.5e-06 ] [ 3.24e-05 5.39e-05 1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.360641184576e-14 -7.626360715008e-14 1.345828361472e-14 ] [ 2.627569658112e-14 -1.105501868352e-14 -2.066807840832e-14 ] [ -9.292624400640001e-15 7.850665441919999e-15 -3.36457090368e-15 ] [ -2.227025502912e-14 1.84250311392e-14 -1.794437815296e-14 ] [ 1.698307218048e-14 -2.531439060864e-14 4.005441552e-15 ] [ 5.191052251392001e-14 8.635731986112e-14 2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }