{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1092618e-10 -3.0622504e-10 1.0853817e-10 ] [ 1.523411e-10 3.7599378e-10 -1.6182552e-10 ] [ 1.611984e-11 1.1155019e-10 7.0578172e-10 ] [ 3.6650101e-10 7.0820228e-10 4.5786328e-10 ] [ 7.141977700000001e-10 8.407458000000001e-11 2.7791855e-10 ] ] "source-value" [ [ 1.1092618 -3.0622504 1.0853817 ] [ 1.523411 3.7599378 -1.6182552 ] [ 0.1611984 1.1155019 7.0578172 ] [ 3.6650101 7.0820228 4.5786328 ] [ 7.1419777 0.8407458 2.7791855 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.6021766208e-16 -4.8065298624e-16 -6.408706483200001e-16 ] [ 0.0 0.0 0.0 ] [ -4.8065298624e-16 -1.6021766208e-16 8.010883104e-16 ] [ 3.2043532416e-16 6.408706483200001e-16 -1.6021766208e-16 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ 1e-07 -3e-07 -4e-07 ] [ 0.0 0.0 0.0 ] [ -3e-07 -1e-07 5e-07 ] [ 2e-07 4e-07 -1e-07 ] [ 0.0 0.0 0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.686329946164105e-31 "source-value" 2.3008262e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.039770589365571e-09 -1.102004845507078e-08 -3.758065001095494e-09 ] [ -3.07801007937825e-09 4.166108784839797e-09 -1.035689249126143e-08 ] [ -6.950935442854221e-09 -1.954073086174339e-09 1.042716139436712e-08 ] [ 1.399755703916183e-09 1.227410926666855e-08 4.403883491255849e-09 ] [ 1.266896056789952e-08 -3.46609651026322e-09 -7.160873932660494e-10 ] ] "source-value" [ [ -2.5214265 -6.8781733 -2.3455997 ] [ -1.9211428 2.6002806 -6.4642639 ] [ -4.3384327 -1.2196365 6.5081223 ] [ 0.8736588 7.6608965 2.7486879 ] [ 7.9073433 -2.1633673 -0.4469466 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.094901146283254e-18 "source-value" 31.799872 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] "source-value" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] } "instance-id" 1 }