{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7146496 -10.745486 -8.6245026 ] [ -2.5762055 -3.7786183 11.8626335 ] [ -3.5965912 7.8100874 -4.9498516 ] [ 3.0885935 6.0038163 2.5011236 ] [ 3.4460814 -2.086998 -1.6399809 ] [ -1.5728316 -4.9266598 2.1555895 ] [ 3.9256031 7.7238586 -1.3050116 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.349348158617447e-09 -1.721616659017412e-08 -1.381797654559225e-08 ] [ -4.127536256482287e-09 -6.054013949064802e-09 1.900603421140564e-08 ] [ -5.762374382690021e-09 1.251313954177781e-08 -7.930536575287512e-09 ] [ 4.948472337624278e-09 9.619174190688334e-09 4.007241790665962e-09 ] [ 5.521231097942008e-09 -3.343739430804731e-09 -2.62753907818629e-09 ] [ -2.519954038736834e-09 -7.893379215227113e-09 3.453635129395743e-09 ] [ 6.289509561177965e-09 1.237498577323995e-08 -2.090859092618954e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.547956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.13192783456601e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7038046 1.4597435 2.4375643 ] [ 2.4521055 2.853505 4.4895554 ] [ 2.5681345 4.0323649 2.2631587 ] [ 4.6688195 2.7758562 1.6184684 ] [ 4.9519519 2.8418838 4.0622266 ] [ 4.850046 5.2277756 2.0871759 ] [ 3.692894 5.031893 4.2870066 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7038046e-10 1.4597435e-10 2.4375643e-10 ] [ 2.4521055e-10 2.853505e-10 4.489555400000001e-10 ] [ 2.5681345e-10 4.0323649e-10 2.2631587e-10 ] [ 4.668819499999999e-10 2.775856200000001e-10 1.6184684e-10 ] [ 4.9519519e-10 2.841883800000001e-10 4.0622266e-10 ] [ 4.850046e-10 5.2277756e-10 2.0871759e-10 ] [ 3.692894e-10 5.031893000000001e-10 4.2870066e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.19e-05 9.22e-05 4.57e-05 ] [ 0.0001139 3e-07 2.43e-05 ] [ 6.9e-05 -4.62e-05 5.53e-05 ] [ 4.73e-05 0.0001121 2.35e-05 ] [ -6.32e-05 -6.67e-05 -2.44e-05 ] [ -7.5e-06 -4.46e-05 4.12e-05 ] [ -9.76e-05 -4.72e-05 -0.0001656 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.917473364459999e-14 1.477206856548e-13 7.32194721738e-14 ] [ 1.824879186126e-13 4.806529901999999e-16 3.893289220619999e-14 ] [ 1.10550187746e-13 -7.40205604908e-14 8.86003678602e-14 ] [ 7.578295478819998e-14 1.796040006714e-13 3.765115089899999e-14 ] [ -1.012575632688e-13 -1.068651814878e-13 -3.909310986959999e-14 ] [ -1.2016324755e-14 -7.145707787639999e-14 6.600967732079998e-14 ] [ -1.563724394784e-13 -7.562273712480001e-14 -2.653204505903999e-13 ] ] } "relaxed-potential-energy" { "source-value" -25.960863 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.159388809707514e-18 } }