{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5926182 -0.4821914 -0.3467718 ] [ -0.2247558 -0.2133817 0.3848799 ] [ 0.4289794 0.6957164 1.0771186 ] [ 0.0179688 -2.8904282 -1.1570517 ] [ 0.4881906 -1.730883 -0.8583896 ] [ 0.0843314 2.6204671 0.2928426 ] [ -1.3873326 2.0007008 0.6073722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.494790329231388e-10 -7.725557941957475e-10 -5.555896752901211e-10 ] [ -3.600984911159772e-10 -3.418751738631978e-10 6.166455826762565e-10 ] [ 6.873007711473395e-10 1.114660559970597e-09 1.725734252966792e-09 ] [ 2.87891915010192e-11 -4.630976524294679e-09 -1.853801198069978e-09 ] [ 7.821675722584403e-10 -2.773180298787822e-09 -1.375291759988606e-09 ] [ 1.351137985925076e-10 4.19845115778574e-09 4.691855711598084e-10 ] [ -2.222751875306468e-09 3.205476073385107e-09 9.731175469811747e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.050654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.212468933521864e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1538503 2.3529027 1.2867053 ] [ 2.2420592 1.3882973 3.4749113 ] [ 2.1620975 3.7719677 3.279496 ] [ 4.4891046 1.8677396 1.0925977 ] [ 4.6232055 1.4357331 3.431272 ] [ 3.8230193 4.1263547 1.5185941 ] [ 4.5002657 3.7875839 3.7886245 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1538503e-10 2.3529027e-10 1.2867053e-10 ] [ 2.2420592e-10 1.3882973e-10 3.4749113e-10 ] [ 2.1620975e-10 3.7719677e-10 3.279496e-10 ] [ 4.4891046e-10 1.8677396e-10 1.0925977e-10 ] [ 4.6232055e-10 1.4357331e-10 3.431272e-10 ] [ 3.8230193e-10 4.1263547e-10 1.5185941e-10 ] [ 4.5002657e-10 3.7875839e-10 3.7886245e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 -1.48e-05 1.92e-05 ] [ 5.8e-06 2.1e-06 -1.63e-05 ] [ 1.77e-05 -1.4e-06 1.01e-05 ] [ -7.6e-06 1.14e-05 6.3e-06 ] [ -2.54e-05 3.17e-05 -1.52e-05 ] [ 1.06e-05 -1.71e-05 -3.2e-06 ] [ -1.16e-05 -1.18e-05 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6822854657e-14 -2.37122141832e-14 3.076179137279999e-14 ] [ 9.2926244772e-15 3.364570931399999e-15 -2.61154791342e-14 ] [ 2.83585264218e-14 -2.2430472876e-15 1.61819840034e-14 ] [ -1.21765424184e-14 1.82648136276e-14 1.00937127942e-14 ] [ -4.06952865036e-14 5.078899929779999e-14 -2.43530848368e-14 ] [ 1.69830723204e-14 -2.73972204414e-14 -5.1269652288e-15 ] [ -1.85852489544e-14 -1.89056842812e-14 -1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319343288959e-18 } }