{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6372948 0.0624513 0.42229 ] [ -5.3931965 -1.1534691 -1.1057889 ] [ -8.1617617 33.7129047 -12.2933311 ] [ 15.0956929 -34.6169799 -8.3797348 ] [ -2.1780294 1.9950931 21.3565648 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.021058829117412e-09 1.00058012798567e-10 6.765831651976319e-10 ] [ -8.640853343680388e-09 -1.848061224835217e-09 -1.771669123120149e-09 ] [ -1.307658378028086e-08 5.401402772959844e-08 -1.969608768017355e-08 ] [ 2.418596623915655e-08 -5.546251587848351e-08 -1.342581518506416e-08 ] [ -3.489587784095051e-09 3.196491521139397e-09 3.421698882316023e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.31728167 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.083412738823808e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.033363 0.0437769 2.5871316 ] [ 0.3665486 1.8264248 0.9748512 ] [ 2.415466 3.1939715 0.5828493 ] [ 2.7309516 0.7396637 0.897187 ] [ 2.0757798 2.2905098 2.882911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.033363e-10 4.377690000000001e-12 2.5871316e-10 ] [ 3.665486e-11 1.8264248e-10 9.748512e-11 ] [ 2.415466e-10 3.1939715e-10 5.828493000000001e-11 ] [ 2.7309516e-10 7.396637e-11 8.97187e-11 ] [ 2.0757798e-10 2.2905098e-10 2.882911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.44e-05 2.72e-05 -5.29e-05 ] [ 2.17e-05 -7.1e-06 3.38e-05 ] [ 2.37e-05 -4.14e-05 -1e-05 ] [ -6.88e-05 3.99e-05 4.68e-05 ] [ -3.1e-05 -1.86e-05 -1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.715840817152e-14 4.357920408576e-14 -8.475514324032001e-14 ] [ 3.476723267136e-14 -1.137545400768e-14 5.415356978304e-14 ] [ 3.797158591296e-14 -6.633011210111999e-14 -1.6021766208e-14 ] [ -1.1022975151104e-13 6.392684716992e-14 7.498186585344001e-14 ] [ -4.96674752448e-14 -2.980048514688e-14 -2.835852618816e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }