{ "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" [ [ 0.8089267 0.144273 0.3085018 ] [ 0.0391703 1.366973 2.60492 ] [ 1.362051 2.292395 1.899207 ] [ 2.93764 0.2840218 0.2571454 ] [ 1.745173 0.2602682 2.163878 ] [ 2.951376 1.632187 2.170679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.089267000000001e-11 1.44273e-11 3.085018e-11 ] [ 3.91703e-12 1.366973e-10 2.60492e-10 ] [ 1.362051e-10 2.292395e-10 1.899207e-10 ] [ 2.93764e-10 2.840218e-11 2.571454e-11 ] [ 1.745173e-10 2.602682e-11 2.163878e-10 ] [ 2.951376e-10 1.632187e-10 2.170679e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.2287001 -2.7418361 -14.5634563 ] [ -72.3577173 -34.480206 37.3297696 ] [ -16.6684665 87.6839851 -47.9280486 ] [ 26.9200144 -0.3570898 -20.7717778 ] [ -24.4887569 -59.3844695 29.6763949 ] [ 108.8236264 9.2796162 16.2571181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.561430361099462e-08 -4.392905697485451e-09 -2.333322920190247e-08 ] [ -1.159298429925157e-07 -5.52433799335679e-08 5.980888411297056e-08 ] [ -2.670582733088801e-08 1.404852309457956e-07 -7.678919894748616e-08 ] [ 4.313061770327934e-08 -5.721209290861478e-10 -3.328005676361245e-08 ] [ -3.923531377763468e-08 -9.514440867151068e-08 4.754682609840835e-08 ] [ 1.743546700087537e-07 1.486758412563694e-08 2.604677454140452e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.242684 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.248677056704223e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8532245 0.5650386 -0.0673477 ] [ -0.1390114 1.3287347 3.2879921 ] [ 0.949884 2.6326735 1.4176935 ] [ 3.3732097 0.0135575 0.2504694 ] [ 1.5765613 -0.3324486 2.3569188 ] [ 3.2304688 1.7725623 2.1586051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.532245000000001e-11 5.650386e-11 -6.73477e-12 ] [ -1.390114e-11 1.3287347e-10 3.2879921e-10 ] [ 9.49884e-11 2.6326735e-10 1.4176935e-10 ] [ 3.3732097e-10 1.35575e-12 2.504694e-11 ] [ 1.5765613e-10 -3.324486e-11 2.3569188e-10 ] [ 3.2304688e-10 1.7725623e-10 2.1586051e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.2e-06 3.5e-06 -2.63e-05 ] [ -2.05e-05 9e-07 1.2e-05 ] [ -1.14e-05 1.2e-06 1.76e-05 ] [ -1.5e-06 -1.24e-05 5.8e-06 ] [ 1.48e-05 1.41e-05 6e-06 ] [ 1.05e-05 -7.3e-06 -1.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.313784829056e-14 5.6076181728e-15 -4.213724512704e-14 ] [ -3.28446207264e-14 1.44195895872e-15 1.92261194496e-14 ] [ -1.826481347712e-14 1.92261194496e-15 2.819830852608e-14 ] [ -2.4032649312e-15 -1.986699009792e-14 9.292624400640001e-15 ] [ 2.371221398784e-14 2.259069035328e-14 9.6130597248e-15 ] [ 1.68228545184e-14 -1.169588933184e-14 -2.4032649312e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.662297 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.150247256462598e-18 } }