{ "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" [ [ 2.266958 0.2808875 2.923165 ] [ 1.972839 2.886908 2.420784 ] [ 0.6227844 1.897999 3.691493 ] [ 3.0949 1.65874 4.813271 ] [ 4.223624 2.255199 3.062463 ] [ 4.675559 3.55825 4.934237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.266958e-10 2.808875e-11 2.923165e-10 ] [ 1.972839e-10 2.886908e-10 2.420784e-10 ] [ 6.227844000000001e-11 1.897999e-10 3.691493e-10 ] [ 3.0949e-10 1.65874e-10 4.813271e-10 ] [ 4.223624e-10 2.255199e-10 3.062463e-10 ] [ 4.675559e-10 3.55825e-10 4.934237000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.571138 -8.5074392 -2.3028604 ] [ -0.0200223 8.3335874 -8.2262526 ] [ -6.6360772 -0.696523 3.4731665 ] [ -0.582794 -4.1575671 11.2245136 ] [ 5.6951499 1.7114087 -6.4046713 ] [ 2.1148817 3.3165333 2.2361041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.150639508504705e-10 -1.363042018911746e-08 -3.689589093846136e-09 ] [ -3.207926095464384e-11 1.335187889967346e-08 -1.317990959251521e-08 ] [ -1.063216774366393e-08 -1.115952866449478e-09 5.564626166445764e-09 ] [ -9.337389215425153e-10 -6.661156807027255e-09 1.798365326977164e-08 ] [ 9.124636021731458e-09 2.741979007773721e-09 -1.026141462076874e-08 ] [ 3.38841401549776e-09 5.313672115364673e-09 3.582633710695025e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5654469 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.372335876988384e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9024914 0.3276278 3.2402645 ] [ 1.9183538 3.3903559 2.1560716 ] [ 0.8756906 1.9343788 3.7331581 ] [ 2.655929 1.6221458 5.5197012 ] [ 4.0250411 2.3222194 2.4702418 ] [ 4.4791585 2.9412558 4.7259758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.902491400000001e-10 3.276278e-11 3.2402645e-10 ] [ 1.9183538e-10 3.3903559e-10 2.1560716e-10 ] [ 8.756906e-11 1.9343788e-10 3.7331581e-10 ] [ 2.655929e-10 1.6221458e-10 5.5197012e-10 ] [ 4.0250411e-10 2.3222194e-10 2.4702418e-10 ] [ 4.4791585e-10 2.9412558e-10 4.7259758e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.85e-05 3.48e-05 1.47e-05 ] [ 9.9e-06 -1.53e-05 2.13e-05 ] [ 3.04e-05 -2.1e-05 -5.4e-06 ] [ -5.4e-06 1.6e-06 -2.6e-05 ] [ 2e-07 3.7e-06 1.5e-05 ] [ -6.5e-06 -3.8e-06 -1.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.56620336928e-14 5.575574640383999e-14 2.355199632576e-14 ] [ 1.586154854592e-14 -2.451330229824e-14 3.412636202304e-14 ] [ 4.870616927232e-14 -3.36457090368e-14 -8.65175375232e-15 ] [ -8.65175375232e-15 2.56348259328e-15 -4.16565921408e-14 ] [ 3.2043532416e-16 5.928053496960001e-15 2.4032649312e-14 ] [ -1.04141480352e-14 -6.08827115904e-15 -3.156287942976e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.124626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423232217554382e-18 } }