{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.889363 -15.6231991 -2.3785154 ] [ -7.9009975 1.6865318 8.9332969 ] [ -8.7272603 3.9332442 -4.0823638 ] [ 4.77183 -6.9258938 -5.5195616 ] [ 8.9097928 -2.8719492 7.8428869 ] [ 3.3727616 2.8173652 -9.6323585 ] [ 10.4632363 16.9839009 4.8366156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.744668281400455e-08 -2.50311243401236e-08 -3.81080176609276e-09 ] [ -1.265879347549925e-08 2.702121820195742e-09 1.431271943984512e-08 ] [ -1.398261241629599e-08 6.3017519011372e-09 -6.540667837960248e-09 ] [ 7.645314464432063e-09 -1.109650512450367e-08 -8.843312552585442e-09 ] [ 1.427506172033217e-08 -4.601369864365263e-09 1.256569003075859e-08 ] [ 5.403759783052002e-09 4.513916655695516e-09 -1.543273959186416e-08 ] [ 1.67639525777659e-08 2.721120895196408e-08 7.749112438116565e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.2892627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.065626556009484e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7376519 1.0249168 2.4460331 ] [ 1.9122469 2.7774825 4.4507454 ] [ 1.3919571 3.6469164 2.0847206 ] [ 4.0550117 1.5393602 2.1248166 ] [ 4.2923956 2.6602994 4.2982238 ] [ 3.6181339 3.7863005 1.2323459 ] [ 4.7738081 4.6864292 3.1226297 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7376519e-10 1.0249168e-10 2.4460331e-10 ] [ 1.9122469e-10 2.7774825e-10 4.4507454e-10 ] [ 1.3919571e-10 3.6469164e-10 2.0847206e-10 ] [ 4.0550117e-10 1.5393602e-10 2.1248166e-10 ] [ 4.2923956e-10 2.6602994e-10 4.2982238e-10 ] [ 3.6181339e-10 3.7863005e-10 1.2323459e-10 ] [ 4.7738081e-10 4.6864292e-10 3.1226297e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 6e-07 -1.6e-05 ] [ 3.3e-06 1.63e-05 2.35e-05 ] [ -1.91e-05 -1.9e-06 -8.6e-06 ] [ 2.27e-05 -1.24e-05 -6.2e-06 ] [ -2.7e-06 -1.12e-05 1.84e-05 ] [ -6.1e-06 6.8e-06 -5.5e-06 ] [ 5.1e-06 1.9e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 9.6130597248e-16 -2.56348259328e-14 ] [ 5.28718284864e-15 2.611547891904e-14 3.76511505888e-14 ] [ -3.060157345728e-14 -3.04413557952e-15 -1.377871893888e-14 ] [ 3.636940929216e-14 -1.986699009792e-14 -9.93349504896e-15 ] [ -4.32587687616e-15 -1.794437815296e-14 2.948004982272e-14 ] [ -9.77327738688e-15 1.089480102144e-14 -8.8119714144e-15 ] [ 8.17110076608e-15 3.04413557952e-15 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.819793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.89373960072955e-18 } }