{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3869132 -12.6824416 7.4589706 ] [ -0.1265826 -0.3197234 -9.043426 ] [ -3.9825312 2.1908378 0.3826118 ] [ 9.0925142 12.4447101 1.1172042 ] [ 3.4035128 -1.6333829 0.0846394 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.343731636042617e-08 -2.031951159358957e-08 1.195058840901296e-08 ] [ -2.028076839909684e-10 -5.122533608230355e-10 -1.448916582850808e-08 ] [ -6.38071843281598e-09 3.510109132043965e-09 6.130116858526811e-10 ] [ 1.45678137955532e-08 1.99386237391238e-08 1.789958464646663e-09 ] [ 5.453028681679915e-09 -2.616967916755158e-09 1.356072689957796e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3428817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.01624168519662e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5231026 2.4996654 3.2635875 ] [ 1.8507526 3.1917014 0.7360606 ] [ 0.6739444 4.8004686 4.2433425 ] [ 2.8509883 4.547347 2.7698799 ] [ 4.0364421 2.5783505 4.0708165 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5231026e-10 2.4996654e-10 3.2635875e-10 ] [ 1.8507526e-10 3.1917014e-10 7.360605999999999e-11 ] [ 6.739444e-11 4.800468600000001e-10 4.2433425e-10 ] [ 2.8509883e-10 4.547347e-10 2.7698799e-10 ] [ 4.036442100000001e-10 2.5783505e-10 4.070816500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.08e-05 2.87e-05 1.84e-05 ] [ 4e-07 1.6e-06 -5.5e-06 ] [ -9e-07 -4.8e-06 -1.9e-05 ] [ -1.39e-05 -2.44e-05 2.51e-05 ] [ -6.4e-06 -1.1e-06 -1.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.332527398719999e-14 4.598246939579999e-14 2.94800500656e-14 ] [ 6.408706536e-16 2.5634826144e-15 -8.811971486999999e-15 ] [ -1.4419589706e-15 -7.690447843199998e-15 -3.0441356046e-14 ] [ -2.22702552126e-14 -3.909310986959999e-14 4.02146335134e-14 ] [ -1.02539304576e-14 -1.7623942974e-15 -3.0441356046e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725931241282e-18 } }