{ "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" [ [ 0.468554 0.0062453 1.779472 ] [ 0.0137549 1.819656 0.3703857 ] [ 0.6368997 2.724291 2.946976 ] [ 2.361208 0.5254432 0.0878272 ] [ 1.952332 1.317185 1.267695 ] [ 2.764287 2.133831 2.76552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.685540000000001e-11 6.2453e-13 1.779472e-10 ] [ 1.37549e-12 1.819656e-10 3.703857e-11 ] [ 6.368997e-11 2.724291e-10 2.946976e-10 ] [ 2.361208e-10 5.254432e-11 8.782719999999999e-12 ] [ 1.952332e-10 1.317185e-10 1.267695e-10 ] [ 2.764287e-10 2.133831e-10 2.76552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3873015 -1.7145601 0.5246332 ] [ -0.1068076 -0.0535663 1.5185103 ] [ -2.6270689 -1.7484034 -2.3537704 ] [ 19.0869483 -41.5663468 -60.0506562 ] [ -20.8054152 40.1216384 50.0746482 ] [ 7.839645 4.9612382 10.2866349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.427055315613151e-09 -2.747028129808703e-09 8.405550544606487e-10 ] [ -1.711246410536184e-10 -8.582267422983418e-11 2.43292172114833e-09 ] [ -4.209028407488082e-09 -2.801251074286155e-09 -3.771155936680833e-09 ] [ 3.058066258062602e-08 -6.659662960370066e-08 -9.621175822000722e-08 ] [ -3.333395009410843e-08 6.428195156227713e-08 8.022843130181014e-08 ] [ 1.256049603785493e-08 7.948779919748219e-09 1.648100607926892e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.465963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.348731664908542e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6691521 0.1855862 2.2618603 ] [ 0.1181031 1.6041926 0.4181125 ] [ 0.584385 2.5630125 2.4988271 ] [ 1.975329 0.2365955 0.3091632 ] [ 2.2938055 2.5060995 0.8284515 ] [ 2.5562608 1.4311651 2.9014612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.691521e-11 1.855862e-11 2.2618603e-10 ] [ 1.181031e-11 1.6041926e-10 4.181125e-11 ] [ 5.843850000000001e-11 2.5630125e-10 2.4988271e-10 ] [ 1.975329e-10 2.365955e-11 3.091632e-11 ] [ 2.2938055e-10 2.5060995e-10 8.284515000000001e-11 ] [ 2.5562608e-10 1.4311651e-10 2.9014612e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -4.65e-05 2.84e-05 ] [ -2.71e-05 1.37e-05 1.56e-05 ] [ 3e-06 1.08e-05 -2.35e-05 ] [ 2.22e-05 3.33e-05 4.08e-05 ] [ 3.78e-05 4.6e-06 3.3e-06 ] [ -3.6e-05 -1.58e-05 -6.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-16 -7.450121348099999e-14 4.550181640559999e-14 ] [ -4.34189867814e-14 2.19498198858e-14 2.49939554904e-14 ] [ 4.806529901999999e-15 1.73035076472e-14 -3.765115089899999e-14 ] [ 3.55683212748e-14 5.33524819122e-14 6.53688066672e-14 ] [ 6.056227676519999e-14 7.370012516399999e-15 5.2871828922e-15 ] [ -5.7678358824e-14 -2.53143908172e-14 -1.035006105564e-13 ] ] } "relaxed-potential-energy" { "source-value" -26.223076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.201399963880618e-18 } }