{ "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" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.243272 0.3989182 1.0700663 ] [ -3.7929737 -6.9164444 -1.1404709 ] [ -19.5494291 10.8879437 3.4725614 ] [ 4.3623274 1.9517156 -12.6983961 ] [ 18.7368035 -6.3221331 9.2962393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.897647108952576e-10 6.391374136516186e-10 1.714435208565959e-09 ] [ -6.077013785449273e-09 -1.108136551674308e-08 -1.827235812682735e-09 ] [ -3.132163825400719e-08 1.744440884472665e-08 5.563656689372517e-09 ] [ 6.98921897255525e-09 3.126993104770645e-09 -2.03450733530779e-08 ] [ 3.001966851622361e-08 -1.012917384640583e-08 1.489421726782216e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.108776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.980808226504141e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2097428 0.4681317 0.1341244 ] [ -0.0907411 0.6596596 2.0845569 ] [ 0.9070237 2.2797888 3.4672231 ] [ 3.0111613 1.9700052 0.3112895 ] [ 2.8239556 3.0898208 2.371164 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2097428e-10 4.681317e-11 1.341244e-11 ] [ -9.074110000000002e-12 6.596596e-11 2.0845569e-10 ] [ 9.070237e-11 2.2797888e-10 3.4672231e-10 ] [ 3.0111613e-10 1.9700052e-10 3.112895e-11 ] [ 2.8239556e-10 3.0898208e-10 2.371164e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.37e-05 -6.2e-06 4.6e-06 ] [ 0.0 -2.24e-05 -8.4e-06 ] [ -6.1e-06 2.46e-05 4.7e-06 ] [ 1.02e-05 5.2e-06 -2.84e-05 ] [ 9.5e-06 -1.1e-06 2.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.194981970496e-14 -9.93349504896e-15 7.370012455680001e-15 ] [ 0.0 -3.588875630592e-14 -1.345828361472e-14 ] [ -9.77327738688e-15 3.941354487168e-14 7.53023011776e-15 ] [ 1.634220153216e-14 8.33131842816e-15 -4.550181603071999e-14 ] [ 1.52206778976e-14 -1.76239428288e-15 4.422007473408001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }