{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8838285 -6.2231544 -4.7241918 ] [ -9.8407302 -14.7553364 16.6654524 ] [ -18.7223971 3.5490659 -11.1711139 ] [ -1.5949228 13.5557509 19.345272 ] [ 12.7732283 -2.822883 5.0583246 ] [ 10.7750155 15.612139 -3.6302592 ] [ 8.4936348 -8.915582 -21.5434842 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.018225980296733e-09 -9.970592487308652e-09 -7.56898965413507e-09 ] [ -1.576658785804051e-08 -2.364065501211924e-08 2.670099821033525e-08 ] [ -2.999658691895372e-08 5.686230410658511e-09 -1.789809751887391e-08 ] [ -2.555348022140874e-09 2.171870716936856e-08 3.099454252141686e-08 ] [ 2.046496775440093e-08 -4.522757145853766e-09 8.10432941453751e-09 ] [ 1.726347792285762e-08 2.50134041064799e-08 -5.816316417684111e-09 ] [ 1.360830310217329e-08 -1.428433704122531e-08 -3.45164667158142e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.5434535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.048376821699193e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1901185 1.2993693 2.0296383 ] [ 3.06001 2.2797567 3.9821965 ] [ 2.1965327 4.7300845 0.3041056 ] [ 2.3232626 4.5077553 4.1358643 ] [ 5.4098868 2.2348987 3.9019578 ] [ 3.066359 5.7105603 2.2566504 ] [ 2.9334214 2.5021397 0.1504926 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1901185e-10 1.2993693e-10 2.0296383e-10 ] [ 3.06001e-10 2.2797567e-10 3.9821965e-10 ] [ 2.1965327e-10 4.7300845e-10 3.041056e-11 ] [ 2.3232626e-10 4.507755300000001e-10 4.1358643e-10 ] [ 5.4098868e-10 2.2348987e-10 3.9019578e-10 ] [ 3.066359e-10 5.7105603e-10 2.2566504e-10 ] [ 2.9334214e-10 2.5021397e-10 1.504926e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.49e-05 -1.24e-05 -3.4e-06 ] [ -1.95e-05 3.07e-05 -1.35e-05 ] [ 1.52e-05 8.3e-06 1.03e-05 ] [ 2.5e-06 -3.18e-05 -8.1e-06 ] [ -4.23e-05 2.69e-05 -9.3e-06 ] [ 3.57e-05 -1.46e-05 7.2e-06 ] [ -5.65e-05 -7.2e-06 1.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.0398126268992e-13 -1.986699009792e-14 -5.44740051072e-15 ] [ -3.12424441056e-14 4.918682225856e-14 -2.16293843808e-14 ] [ 2.435308463616e-14 1.329806595264e-14 1.650241919424e-14 ] [ 4.005441552e-15 -5.094921654144e-14 -1.297763062848e-14 ] [ -6.777207105984e-14 4.309855109952001e-14 -1.490024257344e-14 ] [ 5.719770536256001e-14 -2.339177866368e-14 1.153567166976e-14 ] [ -9.052297907519999e-14 -1.153567166976e-14 2.691656722944e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.204999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.596327053788738e-18 } }