{ "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" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.37144 2.1325422 -3.4957311 ] [ -0.2423794 -0.561164 4.427588 ] [ -2.4544734 -6.2912009 -7.2039587 ] [ 3.445225 -2.5056272 6.6326896 ] [ 0.6230678 7.2254498 -0.3605878 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.197289104829952e-09 3.416709255709398e-09 -5.600778641023467e-09 ] [ -3.883346080435315e-10 -8.990838412346112e-10 7.093777980134631e-09 ] [ -3.932499897855487e-09 -1.007961499873592e-08 -1.154201420634876e-08 ] [ 5.51985894839568e-09 -4.014457320280567e-09 1.06267402101433e-08 ] [ 9.9826466233329e-10 1.157644674432404e-08 -5.777253429057063e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.646288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.865941035270359e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2875102 2.5620146 0.1294948 ] [ 0.7311908 1.6962973 2.3998638 ] [ 1.8567153 0.6682176 0.3575913 ] [ 3.1065351 1.0216167 2.4585323 ] [ 2.5031688 3.0109573 1.1245827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875102e-11 2.5620146e-10 1.294948e-11 ] [ 7.311908e-11 1.6962973e-10 2.3998638e-10 ] [ 1.8567153e-10 6.682176e-11 3.575913e-11 ] [ 3.1065351e-10 1.0216167e-10 2.4585323e-10 ] [ 2.5031688e-10 3.0109573e-10 1.1245827e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.39e-05 1.65e-05 -3.23e-05 ] [ -2.51e-05 -2.66e-05 1.8e-05 ] [ -1.14e-05 -6.4e-06 -2e-07 ] [ 1.74e-05 4.25e-05 -1.01e-05 ] [ 5.3e-05 -2.59e-05 2.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.431378744512e-14 2.64359142432e-14 -5.175030485184e-14 ] [ -4.021463318208e-14 -4.261789811328e-14 2.88391791744e-14 ] [ -1.826481347712e-14 -1.025393037312e-14 -3.2043532416e-16 ] [ 2.787787320192e-14 6.8092506384e-14 -1.618198387008e-14 ] [ 8.49153609024e-14 -4.149637447872e-14 3.92533272096e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.299971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.2911079214318e-18 } }