{ "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" [ [ 2.693951 4.828533 2.524683 ] [ 0.9874005 3.253704 2.692751 ] [ 1.797506 3.29632 4.784436 ] [ 3.246699 2.730573 2.280252 ] [ 4.077425 2.843272 4.278983 ] [ 4.93943 4.110777 2.41493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.693951e-10 4.828533000000001e-10 2.524683e-10 ] [ 9.874005e-11 3.253704e-10 2.692751e-10 ] [ 1.797506e-10 3.29632e-10 4.784436000000001e-10 ] [ 3.246699e-10 2.730573e-10 2.280252e-10 ] [ 4.077425e-10 2.843272e-10 4.278983e-10 ] [ 4.93943e-10 4.110777e-10 2.41493e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4215788 4.2926768 -0.8754645 ] [ -1.1551408 -0.3222903 -0.6887155 ] [ 0.0715347 -0.0508867 1.5886381 ] [ -0.8876119 -4.2228699 -2.4826 ] [ 0.809157 -1.3552775 2.9909856 ] [ 2.5836398 1.6586477 -0.5328437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.277620317984919e-09 6.877626409610558e-09 -1.402648754240361e-09 ] [ -1.850739583492209e-09 -5.163659837706183e-10 -1.103443872482583e-09 ] [ 1.146112239159418e-10 -8.152948104966336e-11 2.545278822732133e-09 ] [ -1.422111034523868e-09 -6.765783426460034e-09 -3.97756367879808e-09 ] [ 1.296412427956666e-09 -2.171393925196272e-09 4.79208720146946e-09 ] [ 4.139447284128388e-09 2.657446567083692e-09 -8.53709718680569e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.144806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.945812423735157e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5417842 5.3783953 2.2695499 ] [ 1.3785062 3.4339853 2.688314 ] [ 1.8461378 3.2138709 4.9337938 ] [ 3.2706259 2.2117636 2.1893733 ] [ 4.0969002 2.6167289 4.4270702 ] [ 4.6084572 4.208435 2.4679339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5417842e-10 5.378395300000001e-10 2.2695499e-10 ] [ 1.3785062e-10 3.4339853e-10 2.688314e-10 ] [ 1.8461378e-10 3.2138709e-10 4.9337938e-10 ] [ 3.2706259e-10 2.2117636e-10 2.1893733e-10 ] [ 4.0969002e-10 2.6167289e-10 4.4270702e-10 ] [ 4.6084572e-10 4.208435e-10 2.4679339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.54e-05 1.06e-05 3.67e-05 ] [ -6.6e-06 1.53e-05 -1.5e-06 ] [ -2.53e-05 3.81e-05 2.5e-06 ] [ 5.52e-05 -2.51e-05 -3.63e-05 ] [ 2.13e-05 1e-06 6.2e-06 ] [ -1.92e-05 -3.99e-05 -7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.069528616832e-14 1.698307218048e-14 5.879988198335999e-14 ] [ -1.057436569728e-14 2.451330229824e-14 -2.4032649312e-15 ] [ -4.053506850624e-14 6.104292925248e-14 4.005441552e-15 ] [ 8.844014946816001e-14 -4.021463318208e-14 -5.815901133504e-14 ] [ 3.412636202304e-14 1.6021766208e-15 9.93349504896e-15 ] [ -3.076179111936e-14 -6.392684716992e-14 -1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }