{ "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" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.0632574 -30.6657588 -27.6919445 ] [ -22.9577911 -31.4741648 52.1981946 ] [ 16.7438729 66.576497 -37.8721827 ] [ -8.5545054 16.1953517 18.4519921 ] [ 28.1151052 -23.1255829 -12.6769693 ] [ 11.7165758 2.4936578 7.5909099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.015576504737259e-08 -4.913196180845186e-08 -4.436738606239115e-08 ] [ -3.678243616563032e-08 -5.042717100176631e-08 8.363072703608881e-08 ] [ 2.68266417020267e-08 1.066673069881614e-07 -6.067792570060623e-08 ] [ -1.370582855438735e-08 2.594781385937354e-08 2.956335034980629e-08 ] [ 4.504536424277251e-08 -3.705126826475227e-08 -2.031074383505934e-08 ] [ 1.877202382259106e-08 3.995280227435562e-09 1.216197837237927e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.522244 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.006284657675308e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0852018 1.3304656 1.8853005 ] [ -0.8877185 1.3124229 2.9209068 ] [ -0.21911 3.0050752 1.2073132 ] [ -2.1830827 2.9910081 2.2503383 ] [ 3.0701976 0.390058 1.7310999 ] [ 5.1748947 -0.2076297 1.9668092 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0852018e-10 1.3304656e-10 1.8853005e-10 ] [ -8.877185e-11 1.3124229e-10 2.9209068e-10 ] [ -2.1911e-11 3.0050752e-10 1.2073132e-10 ] [ -2.1830827e-10 2.9910081e-10 2.2503383e-10 ] [ 3.0701976e-10 3.90058e-11 1.7310999e-10 ] [ 5.174894700000001e-10 -2.076297e-11 1.9668092e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0289718 0.0189576 0.0075138 ] [ -0.0011804 0.0086806 -0.0075155 ] [ -0.0070153 -0.0057866 0.0071971 ] [ -0.0187478 0.0058846 -0.0016139 ] [ 0.0768413 -0.0281794 0.0022583 ] [ -0.0209262 0.0004433 -0.0078397 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.641794062249344e-11 3.037342350647808e-11 1.203843469336704e-11 ] [ -1.89120928319232e-12 1.390785437451648e-11 -1.20411583936224e-11 ] [ -1.123974964789824e-11 -9.271155233921281e-12 1.153102535755968e-11 ] [ -3.003728685143424e-11 9.428168542759681e-12 -2.58575284830912e-12 ] [ 1.231133343718791e-10 -4.514837586817151e-11 3.61819546275264e-12 ] [ -3.352746840218496e-11 7.1024489600064e-13 -1.256058405408576e-11 ] ] } "relaxed-potential-energy" { "source-value" -12.933863 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.072233291523015e-18 } }