{ "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" [ [ 2.570437 1.678388 2.565083 ] [ 2.924882 3.183881 4.210831 ] [ 1.144354 3.791418 3.165706 ] [ 4.144212 1.310941 0.7169232 ] [ 4.636642 2.415393 2.866782 ] [ 3.821758 3.649635 1.198039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.570437e-10 1.678388e-10 2.565083e-10 ] [ 2.924882e-10 3.183881e-10 4.210831e-10 ] [ 1.144354e-10 3.791418000000001e-10 3.165706e-10 ] [ 4.144212e-10 1.310941e-10 7.169232e-11 ] [ 4.636642e-10 2.415393e-10 2.866782e-10 ] [ 3.821758e-10 3.649635e-10 1.198039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8082054 -1.633924 -3.3530637 ] [ 2.757879 0.1949998 2.2876374 ] [ -1.2665102 0.6213969 -1.2719005 ] [ -0.272981 1.54925 2.9773351 ] [ 1.9138294 -0.4035629 0.1969567 ] [ -1.3240118 -0.3281599 -0.8369649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.897064441352623e-09 -2.617834854531816e-09 -5.372200312453585e-09 ] [ 4.418609293199285e-09 3.124241231946732e-10 3.665199189344511e-09 ] [ -2.029173049162667e-09 9.955875936200347e-10 -2.037809261872917e-09 ] [ -4.373637797259539e-10 2.4821721502245e-09 4.770216728808052e-09 ] [ 3.06629274614224e-09 -6.465790487292785e-10 3.155594226497478e-10 ] [ -2.121300769100281e-09 -5.257701239957765e-10 -1.340965606258147e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.015871055642622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.085372447650752e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3208759 2.0349746 2.0811149 ] [ 3.241974 3.7862744 3.6081974 ] [ 1.0912465 3.11678 3.5536584 ] [ 4.1621049 1.4682911 0.8671773 ] [ 4.4677434 1.9201481 3.1481943 ] [ 3.9583404 3.7031879 1.4650219 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3208759e-10 2.0349746e-10 2.0811149e-10 ] [ 3.241974e-10 3.7862744e-10 3.6081974e-10 ] [ 1.0912465e-10 3.11678e-10 3.5536584e-10 ] [ 4.1621049e-10 1.4682911e-10 8.671773000000001e-11 ] [ 4.4677434e-10 1.9201481e-10 3.1481943e-10 ] [ 3.9583404e-10 3.7031879e-10 1.4650219e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.115575 -0.0071222 -0.0671091 ] [ -0.0071748 0.0359662 0.0862844 ] [ -0.0141266 -0.0130838 0.0122608 ] [ 0.0129466 -0.0839776 -0.0335312 ] [ 0.0994178 -0.023571 0.0734545 ] [ 0.0245119 0.0917885 -0.0713594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.8517156447455e-10 -1.14110224226748e-11 -1.075206319487694e-10 ] [ -1.14952969136232e-11 5.762420525377079e-11 1.382428495587096e-10 ] [ -2.26333084378644e-11 -2.09625586439292e-11 1.96439672741472e-11 ] [ 2.07427400097444e-11 -1.345469484993984e-10 -5.372290514998079e-11 ] [ 1.592848761636852e-10 -3.7764905440014e-11 1.17687083562153e-10 ] [ 3.927239343494459e-11 1.47061389969909e-10 -1.143303632962596e-10 ] ] } "relaxed-potential-energy" { "source-value" -16.033454055642622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.568842545026314e-18 } }