{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6201784 -4.8742808 -6.8043968 ] [ -3.7543146 -8.6717369 14.3431242 ] [ -11.3549138 6.2042881 -3.3880059 ] [ 5.3152315 -0.33807 -8.9288504 ] [ 6.5435509 -1.8807912 4.3812517 ] [ 1.5924719 2.5572657 -4.7307946 ] [ 6.2781526 7.0033252 5.1276718 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.402341816405152e-09 -7.809458740974322e-09 -1.090184547160633e-08 ] [ -6.015075079248103e-09 -1.389365412290867e-08 2.298021826247071e-08 ] [ -1.819257742155929e-08 9.940365342527652e-09 -5.428183844112462e-09 ] [ 8.515939643439716e-09 -5.41647850193856e-10 -1.430559536150073e-08 ] [ 1.04839242689948e-08 -3.013359689246377e-09 7.019539043580255e-09 ] [ 2.551421247460956e-09 4.097191317713746e-09 -7.579568505926889e-09 ] [ 1.005870931753474e-08 1.122056390329948e-08 8.215435877095453e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.301896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.810763354191304e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6384342 1.4229002 2.5761529 ] [ 2.5014694 1.4771093 4.5440158 ] [ 1.4061548 4.2231039 3.335852 ] [ 4.6339863 2.215585 1.9097793 ] [ 5.3332203 1.9758433 3.9744629 ] [ 4.0238591 4.0911406 1.5615642 ] [ 3.0363759 4.5942597 4.4451799 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6384342e-10 1.4229002e-10 2.5761529e-10 ] [ 2.5014694e-10 1.4771093e-10 4.544015800000001e-10 ] [ 1.4061548e-10 4.2231039e-10 3.335852e-10 ] [ 4.6339863e-10 2.215585e-10 1.9097793e-10 ] [ 5.3332203e-10 1.9758433e-10 3.9744629e-10 ] [ 4.0238591e-10 4.0911406e-10 1.5615642e-10 ] [ 3.0363759e-10 4.5942597e-10 4.4451799e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3045863 -3.4159456 2.3799595 ] [ -2.9188917 -0.7587669 -2.086473 ] [ -0.5955297 3.1219649 0.6283031 ] [ 1.2820946 -0.0705123 1.4154017 ] [ -0.8276275 0.6579321 -3.7628322 ] [ 0.7942503 -0.7710648 0.5368029 ] [ -0.0388823 1.2363926 0.888838 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.692354290475975e-09 -5.472948178244628e-09 3.813115469350858e-09 ] [ -4.676580040387168e-09 -1.215678587816892e-09 -3.342898260530438e-09 ] [ -9.54143762332038e-10 5.00193917373821e-09 1.006652537596165e-09 ] [ 2.054141993773928e-09 -1.129731585388358e-10 2.267723512780576e-09 ] [ -1.326005431231152e-09 1.054123428693848e-09 -6.02872177883343e-09 ] [ 1.272529261723386e-09 -1.235381995681828e-09 8.600530563576404e-10 ] [ -6.229631202293185e-11 1.980919317850126e-09 1.42407546327863e-09 ] ] } "relaxed-potential-energy" { "source-value" -24.57845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.937901796550177e-18 } }