{ "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" [ [ 2.273702 2.402034 1.908702 ] [ 1.908149 2.590409 4.360855 ] [ 2.360817 4.517724 2.766871 ] [ 3.26801 0.6931896 3.511788 ] [ 4.292326 2.985376 3.423625 ] [ 4.772846 4.542174 1.540942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.273702e-10 2.402034e-10 1.908702e-10 ] [ 1.908149e-10 2.590409e-10 4.360855e-10 ] [ 2.360817e-10 4.517724e-10 2.766871e-10 ] [ 3.26801e-10 6.931896e-11 3.511788e-10 ] [ 4.292326e-10 2.985376e-10 3.423625e-10 ] [ 4.772846e-10 4.542174e-10 1.540942e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1777805 -2.0955933 -2.5012069 ] [ -0.9731725 -0.1260479 1.3553047 ] [ 0.6768824 3.0208503 -0.1153037 ] [ -0.1718914 -0.5136996 -0.102292 ] [ 2.5058204 0.1270563 0.835191 ] [ -1.8598584 -0.4125659 0.5283069 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.848357607341344e-10 -3.357510591965121e-09 -4.007375218963644e-09 ] [ -1.559194227505488e-09 -2.019509984809363e-10 2.171437504400358e-09 ] [ 1.084485156310994e-09 4.839935725596666e-09 -1.84736892431737e-10 ] [ -2.754003823965811e-10 -8.230374892343119e-10 -1.638898508948736e-10 ] [ 4.014766860803704e-09 2.035666333853511e-10 1.338123494102573e-09 ] [ -2.979821646478495e-09 -6.610034395193107e-10 8.464409637873235e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.121866 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.903443003047042e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4963934 2.4316224 1.699235 ] [ 1.8536682 2.6169496 4.2470623 ] [ 2.4930396 4.720142 3.0036632 ] [ 3.3071049 0.7805263 3.4244958 ] [ 4.3961883 3.038128 3.702027 ] [ 4.3294557 4.1435383 1.4362997 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4963934e-10 2.4316224e-10 1.699235e-10 ] [ 1.8536682e-10 2.6169496e-10 4.2470623e-10 ] [ 2.4930396e-10 4.720142e-10 3.0036632e-10 ] [ 3.3071049e-10 7.805263e-11 3.4244958e-10 ] [ 4.3961883e-10 3.038128e-10 3.702027e-10 ] [ 4.3294557e-10 4.143538300000001e-10 1.4362997e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.06e-05 2.36e-05 3.64e-05 ] [ 2.38e-05 5.4e-06 -2.86e-05 ] [ -1.73e-05 -1.89e-05 1.52e-05 ] [ -1.45e-05 3.2e-06 5.9e-06 ] [ -2.23e-05 1.2e-06 -2.77e-05 ] [ -3e-07 -1.45e-05 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.902660459647999e-14 3.781136825088e-14 5.831922899712e-14 ] [ 3.813180357504e-14 8.65175375232e-15 -4.582225135488e-14 ] [ -2.771765553984e-14 -3.028113813312e-14 2.435308463616e-14 ] [ -2.32315610016e-14 5.126965186560001e-15 9.45284206272e-15 ] [ -3.572853864384e-14 1.92261194496e-15 -4.438029239616e-14 ] [ -4.8065298624e-16 -2.32315610016e-14 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }