{ "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" [ [ -11.3305465 -6.8662186 1.6583308 ] [ 3.0222438 -2.7905161 3.7326624 ] [ 1.110553 -4.6367968 -5.6461378 ] [ 848.50508 -1651.4603128 -2459.4562923 ] [ -877.4914561 1629.7504681 2392.8232986 ] [ 36.1841257 36.0033762 66.8881383 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.815353670318727e-08 -1.100089491422211e-08 2.656938837312561e-09 ] [ 4.842168358717752e-09 -4.470899655385995e-09 5.980384430619218e-09 ] [ 1.779302052759302e-09 -7.428967428360254e-09 -9.046109980975146e-09 ] [ 1.359455001806034e-06 -2.645931103347215e-06 -3.940483371402511e-06 ] [ -1.40589629591517e-06 2.611148097727676e-06 3.833725546722458e-06 ] [ 5.797336024062844e-08 5.768376761750714e-08 1.07166611393097e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 328.11763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.257023956583048e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.0764736 0.4159295 2.0590806 ] [ 0.1383348 1.6262648 0.4574705 ] [ 0.5504492 2.5355393 2.434205 ] [ 1.7634357 0.1954348 -0.0283075 ] [ 2.2253006 2.0585891 1.0639654 ] [ 2.4430416 1.694894 3.2314619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0764736e-10 4.159295000000001e-11 2.0590806e-10 ] [ 1.383348e-11 1.6262648e-10 4.574705e-11 ] [ 5.504492e-11 2.5355393e-10 2.434205e-10 ] [ 1.7634357e-10 1.954348e-11 -2.83075e-12 ] [ 2.2253006e-10 2.0585891e-10 1.0639654e-10 ] [ 2.4430416e-10 1.694894e-10 3.231461900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.38e-05 0.0001157 6.69e-05 ] [ 6.51e-05 -3.97e-05 6e-05 ] [ 3.46e-05 -3.33e-05 -6.8e-06 ] [ 5.9e-05 -7.86e-05 -5.54e-05 ] [ -5.91e-05 0.0001282 -2.28e-05 ] [ -1.59e-05 -9.23e-05 -4.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.3426240082304e-13 1.8537183502656e-13 1.0718561593152e-13 ] [ 1.0430169801408e-13 -6.360641184576e-14 9.6130597248e-14 ] [ 5.543531107968001e-14 -5.335248147264001e-14 -1.089480102144e-14 ] [ 9.45284206272e-14 -1.2593108239488e-13 -8.876058479231999e-14 ] [ -9.468863828927999e-14 2.0539904278656e-13 -3.652962695424e-14 ] [ -2.547460827072e-14 -1.4788090209984e-13 -6.713120041152e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }