{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.0872967e-10 -2.518923e-11 3.3248383e-10 ] [ 5.419787e-11 4.7139735e-10 9.25109e-11 ] [ 1.6381512e-10 4.6062955e-10 6.3136904e-10 ] [ 6.078778400000001e-10 7.163730000000001e-12 1.005084e-10 ] [ 6.0352933e-10 1.3037481e-10 6.4049016e-10 ] [ 5.8805087e-10 5.4477018e-10 2.2128478e-10 ] ] "source-value" [ [ 1.0872967 -0.2518923 3.3248383 ] [ 0.5419787 4.7139735 0.925109 ] [ 1.6381512 4.6062955 6.3136904 ] [ 6.0787784 0.0716373 1.005084 ] [ 6.0352933 1.3037481 6.4049016 ] [ 5.8805087 5.4477018 2.2128478 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 -1.6021766208e-16 ] [ -1.6021766208e-16 0.0 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 -1.6021766208e-16 0.0 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 0.0 -1e-07 ] [ -1e-07 0.0 1e-07 ] [ 0.0 0.0 0.0 ] [ 1e-07 -1e-07 0.0 ] [ 0.0 0.0 0.0 ] ] } "species" { "source-value" [ "Si" "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" 2.276829964257879e-33 "source-value" 1.4210855e-14 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.444510889619844e-08 -2.159341391348642e-08 -3.934950907649987e-09 ] [ -1.527983105952825e-08 1.284728522905949e-08 -1.452754665117444e-08 ] [ -8.876702714451224e-09 1.302381176739794e-08 2.095860157562265e-08 ] [ 1.319680614715817e-08 -1.741119716533643e-08 -1.429836746211131e-08 ] [ 1.322250618167944e-08 -6.34543668866227e-09 2.046417756089155e-08 ] [ 1.21823303413403e-08 1.947895077102768e-08 -8.661914115578465e-09 ] ] "source-value" [ [ -9.0159279 -13.477549 -2.4560032 ] [ -9.5369205 8.0186448 -9.0673815 ] [ -5.5404021 8.128824 13.0813303 ] [ 8.2367986 -10.8672146 -8.9243391 ] [ 8.2528393 -3.9605101 12.7727351 ] [ 7.6036126 12.1578049 -5.4063416 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 9.521181624738927e-18 "source-value" 59.426542 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.448876e-10 1.489587e-10 3.211478e-10 ] [ 1.818052e-10 3.686595e-10 2.502768e-10 ] [ 2.645526e-10 3.343853e-10 4.556562e-10 ] [ 4.834539e-10 1.578647e-10 2.504909e-10 ] [ 4.649923e-10 2.062861e-10 4.836234000000001e-10 ] [ 4.865090999999999e-10 3.729921e-10 2.57452e-10 ] ] "source-value" [ [ 2.448876 1.489587 3.211478 ] [ 1.818052 3.686595 2.502768 ] [ 2.645526 3.343853 4.556562 ] [ 4.834539 1.578647 2.504909 ] [ 4.649923 2.062861 4.836234 ] [ 4.865091 3.729921 2.57452 ] ] } "instance-id" 1 }