{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.507063 6.3291153 -13.5415248 ] [ 2.7475057 -7.8456886 13.7454968 ] [ -0.5809764 0.7492545 0.5271266 ] [ -1.5570923 0.3880024 -3.1760528 ] [ -0.1023742 0.3793164 2.4449542 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.124044838727105e-10 1.014036056400758e-08 -2.16959144445434e-08 ] [ 4.401989398054739e-09 -1.257017884899708e-08 2.202271361424121e-08 ] [ -9.308268053165491e-10 1.200438042929194e-09 8.445499147217934e-10 ] [ -2.4947368794877e-09 6.216483740942899e-10 -5.088597542586378e-09 ] [ -1.640215498131033e-10 6.077318679660212e-10 3.917248458166768e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.549296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.331054190029896e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.583087 2.7999911 0.4759202 ] [ 0.3163645 1.8000342 2.5912691 ] [ 1.7147748 0.6596234 1.0781028 ] [ 2.8233308 2.3665549 -0.1064807 ] [ 2.4116881 2.7902728 2.1731604 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.83087e-11 2.7999911e-10 4.759202e-11 ] [ 3.163645e-11 1.8000342e-10 2.5912691e-10 ] [ 1.7147748e-10 6.596234e-11 1.0781028e-10 ] [ 2.8233308e-10 2.3665549e-10 -1.064807e-11 ] [ 2.4116881e-10 2.7902728e-10 2.1731604e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.57e-05 -2.14e-05 2.11e-05 ] [ 1.71e-05 3.1e-06 -4.1e-06 ] [ -1.51e-05 3.91e-05 1.29e-05 ] [ 1.96e-05 4.1e-06 -2.05e-05 ] [ -3.72e-05 -2.49e-05 -9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.515417294656e-14 -3.428657968511999e-14 3.380592669888e-14 ] [ 2.739722021568e-14 4.96674752448e-15 -6.568924145279999e-15 ] [ -2.419286697408e-14 6.264510587328001e-14 2.066807840832e-14 ] [ 3.140266176767999e-14 6.568924145279999e-15 -3.28446207264e-14 ] [ -5.960097029376001e-14 -3.989419785791999e-14 -1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }