{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5251451 -2.081179 -3.2663118 ] [ 0.823373 -3.3854415 0.5972155 ] [ -2.3608658 2.5417286 -2.432631 ] [ -0.3942005 -2.1361542 1.5647574 ] [ 1.9689576 1.7492191 0.5806967 ] [ 2.5097527 2.0120018 -2.782741 ] [ 0.9781282 1.2998253 5.7390142 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.647905064147679e-09 -3.334416337499923e-09 -5.233208402203165e-09 ] [ 1.319188970797958e-09 -5.424075222386083e-09 9.568447116793825e-10 ] [ -3.782523989606289e-09 4.072298139338715e-09 -3.897504515233326e-09 ] [ -6.315788250076705e-10 -3.422496317663727e-09 2.507017723503794e-09 ] [ 3.154617834066478e-09 2.802557946676817e-09 9.303786765157113e-10 ] [ 4.021067099929676e-09 3.223582244967518e-09 -4.458442571941613e-09 ] [ 1.567134134185186e-09 2.082549706784346e-09 9.194914377679216e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.07976 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.056914540247501e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7440162 2.8974081 2.581351 ] [ 4.7510312 1.5045732 2.1699583 ] [ 3.3693134 2.9894 0.932391 ] [ 3.2446742 1.5967679 3.925103 ] [ 5.9895365 3.297567 2.9272649 ] [ 4.4465824 4.774557 1.9885992 ] [ 3.4787891 4.0303357 4.0184719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7440162e-10 2.8974081e-10 2.581351e-10 ] [ 4.7510312e-10 1.5045732e-10 2.1699583e-10 ] [ 3.3693134e-10 2.9894e-10 9.32391e-11 ] [ 3.2446742e-10 1.5967679e-10 3.925103e-10 ] [ 5.9895365e-10 3.297567e-10 2.9272649e-10 ] [ 4.4465824e-10 4.774557e-10 1.9885992e-10 ] [ 3.4787891e-10 4.0303357e-10 4.0184719e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.01e-05 -2.82e-05 2.5e-06 ] [ 1.86e-05 6.2e-06 -1.51e-05 ] [ -3.1e-06 2.88e-05 2.51e-05 ] [ -2.29e-05 4.1e-06 -6e-07 ] [ -2.1e-06 -8.5e-06 -2.4e-06 ] [ 8.6e-06 -2.36e-05 -2.07e-05 ] [ -9.2e-06 2.13e-05 1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.618198387008e-14 -4.518138070656001e-14 4.005441552e-15 ] [ 2.980048514688e-14 9.93349504896e-15 -2.419286697408e-14 ] [ -4.96674752448e-15 4.614268667904e-14 4.021463318208e-14 ] [ -3.668984461632e-14 6.568924145279999e-15 -9.6130597248e-16 ] [ -3.36457090368e-15 -1.36185012768e-14 -3.84522388992e-15 ] [ 1.377871893888e-14 -3.781136825088e-14 -3.316505605055999e-14 ] [ -1.474002491136e-14 3.412636202304e-14 1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }