{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6327011 1.8412112 -5.6532956 ] [ 1.6904699 -0.8477916 1.6785329 ] [ 0.054527 -1.3374133 1.4024319 ] [ 0.321732 -2.5570754 -3.8354385 ] [ 2.5659721 2.9010692 6.4077694 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.422405454726097e-09 2.949945562899101e-09 -9.057578115415009e-09 ] [ 2.708431374260316e-09 -1.358311892021474e-09 2.689306191780258e-09 ] [ 8.736188532211799e-11 -2.142772339260832e-09 2.246943620956225e-09 ] [ 5.154714928100879e-10 -4.096886457256203e-09 -6.145049945844009e-09 ] [ 4.111140542115911e-09 4.648025285857072e-09 1.02663784087402e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.1903181 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.312233628484728e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3493655 2.6618636 0.7065724 ] [ 2.9016086 0.897091 2.7421707 ] [ 2.1964802 4.2032313 2.2252419 ] [ 3.3333966 1.1680421 0.2731803 ] [ 3.2072891 3.0540857 3.5507381 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3493655e-10 2.6618636e-10 7.065724e-11 ] [ 2.9016086e-10 8.97091e-11 2.7421707e-10 ] [ 2.1964802e-10 4.2032313e-10 2.2252419e-10 ] [ 3.3333966e-10 1.1680421e-10 2.731803e-11 ] [ 3.2072891e-10 3.0540857e-10 3.5507381e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.33e-05 2.87e-05 -2.5e-06 ] [ 3.39e-05 3.26e-05 3.34e-05 ] [ -1.2e-05 2.24e-05 -6.79e-05 ] [ 5.3e-06 1.67e-05 2.29e-05 ] [ 6.1e-06 -0.0001004 1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.33524819122e-14 4.598246939579999e-14 -4.005441585e-15 ] [ 5.431378789259999e-14 5.22309582684e-14 5.351269957559999e-14 ] [ -1.9226119608e-14 3.588875660159999e-14 -1.087877934486e-13 ] [ 8.4915361602e-15 2.67563497878e-14 3.66898449186e-14 ] [ 9.773277467399999e-15 -1.608585340536e-13 2.243047287599999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.174815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.790402748227271e-18 } }