{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6046942 -17.3178903 8.577609 ] [ -9.905657 18.1329449 -4.0165882 ] [ -19.9724116 -5.2715736 -0.4188182 ] [ -0.8164996 -6.8437241 -18.139808 ] [ 1.8501433 5.6338733 19.3466826 ] [ 14.7074598 -7.3669925 -1.2845926 ] [ 13.5322709 13.0333624 -4.0644847 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.688269099733593e-10 -2.774631896023909e-08 1.374284460216367e-08 ] [ -1.587061205906386e-08 2.905218038503459e-08 -6.435283709421155e-09 ] [ -3.199933092651472e-08 -8.445991976746491e-09 -6.710207284055385e-10 ] [ -1.308176570012552e-09 -1.096485475222552e-08 -2.906317628340081e-08 ] [ 2.964256340389761e-09 9.026460085809346e-09 3.099680255175816e-08 ] [ 2.356394824291585e-08 -1.180322314910895e-08 -2.058144230972686e-09 ] [ 2.168108806231217e-08 2.088174852769378e-08 -6.512022361939303e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 88.496982 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.417877955717584e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.4894584 -0.2253316 4.5891729 ] [ 0.3102198 7.612326 1.8795436 ] [ -1.8422372 2.6283109 2.7607482 ] [ 2.4543901 2.5942472 -0.8306054 ] [ 2.8409044 5.0544389 6.2935814 ] [ 7.101246 1.5840612 2.2001328 ] [ 5.760656 6.8955504 1.7093166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4894584e-10 -2.253316e-11 4.5891729e-10 ] [ 3.102198e-11 7.612326000000001e-10 1.8795436e-10 ] [ -1.8422372e-10 2.6283109e-10 2.7607482e-10 ] [ 2.4543901e-10 2.5942472e-10 -8.306054000000001e-11 ] [ 2.8409044e-10 5.0544389e-10 6.2935814e-10 ] [ 7.101246e-10 1.5840612e-10 2.2001328e-10 ] [ 5.760656e-10 6.895550400000001e-10 1.7093166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 2.6645353e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.269056162956315e-34 } }