{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3107125 -0.1718705 -0.9053353 ] [ -1.3968093 0.4668103 1.4481709 ] [ 0.2298009 -1.3931656 -0.3101227 ] [ 1.2753105 0.5420665 2.4610571 ] [ -0.0386406 0.3183341 0.5779065 ] [ 2.1735265 0.1759676 -3.3792018 ] [ 0.0675244 0.0618575 0.1075253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.70216954489032e-09 -2.753668969052065e-10 -1.450507051644954e-09 ] [ -2.237935204176013e-09 7.479125490086343e-10 2.320225558902895e-09 ] [ 3.681816294187987e-10 -2.232097353222804e-09 -4.968713395193721e-10 ] [ 2.043272667360758e-09 8.684862732188832e-10 3.943048148073848e-09 ] [ -6.190906593368448e-11 5.100274526234093e-10 9.259082833083552e-10 ] [ 3.482373342989251e-09 2.819311747382861e-10 -5.414078120925278e-09 ] [ 1.081860150135475e-10 9.9106640321136e-11 1.722745218045063e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.567509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.654407558469359e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7415042 2.6639837 1.6572435 ] [ 1.8075679 3.2120314 3.90057 ] [ 3.4733289 1.150759 1.4377362 ] [ 5.3937086 3.4385284 3.4791538 ] [ 3.2537674 4.3355235 1.2810796 ] [ 5.0074575 2.8702598 1.2734501 ] [ 3.4904326 4.7474952 3.5164259 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7415042e-10 2.6639837e-10 1.6572435e-10 ] [ 1.8075679e-10 3.2120314e-10 3.90057e-10 ] [ 3.4733289e-10 1.150759e-10 1.4377362e-10 ] [ 5.393708600000001e-10 3.4385284e-10 3.4791538e-10 ] [ 3.2537674e-10 4.3355235e-10 1.2810796e-10 ] [ 5.0074575e-10 2.8702598e-10 1.2734501e-10 ] [ 3.4904326e-10 4.747495200000001e-10 3.5164259e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 -2.2e-05 2.7e-06 ] [ 3.3e-06 5e-07 1.62e-05 ] [ -3.03e-05 -2.62e-05 -1.93e-05 ] [ 2.9e-06 -1.01e-05 -1.19e-05 ] [ 5.5e-06 2.28e-05 8e-07 ] [ 2.89e-05 1.61e-05 2.41e-05 ] [ -1.31e-05 1.89e-05 -1.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 -3.52478856576e-14 4.32587687616e-15 ] [ 5.28718284864e-15 8.010883104e-16 2.595526125696e-14 ] [ -4.854595161024e-14 -4.197702746496e-14 -3.092200878144e-14 ] [ 4.646312200320001e-15 -1.618198387008e-14 -1.906590178752e-14 ] [ 8.8119714144e-15 3.652962695424e-14 1.28174129664e-15 ] [ 4.630290434112001e-14 2.579504359488e-14 3.861245656128e-14 ] [ -2.098851373248e-14 3.028113813312e-14 -2.034764308416e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }