{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0279754 -3.1619245 1.5759577 ] [ -3.3617944 2.2072129 -5.8665766 ] [ -3.4623957 1.75732 7.8983249 ] [ 5.2865333 -3.8339715 -3.6669796 ] [ 4.5656321 3.0313631 0.0592736 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.851351394237528e-09 -5.06596151063473e-09 2.52496258230974e-09 ] [ -5.386188391616363e-09 3.536344905508169e-09 -9.399291872652354e-09 ] [ -5.547369442498451e-09 2.815537019264256e-09 1.26545114982625e-08 ] [ 8.469960058340673e-09 -6.142699502113507e-09 -5.875148984070535e-09 ] [ 7.314949009794009e-09 4.856779087975813e-09 9.49667761506509e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1403055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.144003053746966e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2311098 0.622248 1.8916802 ] [ 0.6818951 0.635087 -0.2917193 ] [ 1.1557539 1.9940249 3.230838 ] [ 2.9281086 1.3527331 -0.0932178 ] [ 3.1539468 2.3813153 2.025265 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.311098e-11 6.222480000000001e-11 1.8916802e-10 ] [ 6.818951e-11 6.35087e-11 -2.917193e-11 ] [ 1.1557539e-10 1.9940249e-10 3.230838e-10 ] [ 2.9281086e-10 1.3527331e-10 -9.32178e-12 ] [ 3.1539468e-10 2.3813153e-10 2.025265e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.28e-05 -3.07e-05 2.52e-05 ] [ -1.69e-05 4.62e-05 -2.54e-05 ] [ -3.12e-05 9.9e-06 -5.3e-06 ] [ 7.5e-06 -2.89e-05 3.11e-05 ] [ 7.9e-06 3.4e-06 -2.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.255139316223999e-14 -4.918682225856e-14 4.037485084416e-14 ] [ -2.707678489152e-14 7.402055988096e-14 -4.069528616832e-14 ] [ -4.998791056896e-14 1.586154854592e-14 -8.491536090240001e-15 ] [ 1.2016324656e-14 -4.630290434112001e-14 4.982769290688e-14 ] [ 1.265719530432e-14 5.44740051072e-15 -4.08555038304e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }