{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2659327 -26.4036982 -1.6421409 ] [ -1.1175917 2.0969926 8.4892915 ] [ -5.9205299 23.8158753 -11.1244173 ] [ 6.6994782 -2.3992765 3.5252476 ] [ 3.6045761 2.8901067 0.7520191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.23260101704622e-09 -4.230338795869905e-08 -2.630999758039471e-09 ] [ -1.790579293340127e-09 3.359752517710606e-09 1.360134436845616e-08 ] [ -9.485734588527362e-09 3.815723860954819e-08 -1.782328131808306e-08 ] [ 1.073374734359926e-08 -3.844064715134851e-09 5.648069287251311e-09 ] [ 5.775167555314444e-09 4.630461386357439e-09 1.204867420415057e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.468857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.837513455269843e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2921055 1.0988139 2.3945748 ] [ 1.4709946 2.8895625 4.4666755 ] [ 1.2934909 3.6545882 1.8369041 ] [ 3.5890588 1.3645352 3.6178442 ] [ 3.5904002 3.9203272 3.0602524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2921055e-10 1.0988139e-10 2.3945748e-10 ] [ 1.4709946e-10 2.8895625e-10 4.4666755e-10 ] [ 1.2934909e-10 3.6545882e-10 1.8369041e-10 ] [ 3.5890588e-10 1.3645352e-10 3.6178442e-10 ] [ 3.5904002e-10 3.9203272e-10 3.0602524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.1e-06 -5.3e-06 -5.8e-06 ] [ -1.51e-05 1.48e-05 -1.29e-05 ] [ 2.6e-06 8e-06 2.68e-05 ] [ 1.37e-05 -2.63e-05 8.9e-06 ] [ -7.4e-06 8.9e-06 -1.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.77327738688e-15 -8.491536090240001e-15 -9.292624400640001e-15 ] [ -2.419286697408e-14 2.371221398784e-14 -2.066807840832e-14 ] [ 4.16565921408e-15 1.28174129664e-14 4.293833343744e-14 ] [ 2.194981970496e-14 -4.213724512704e-14 1.425937192512e-14 ] [ -1.185610699392e-14 1.425937192512e-14 -2.72370025536e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.806069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.692629083935164e-18 } }