{ "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" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.4776044 -6.7560466 0.3188126 ] [ 4.6601178 -4.0434368 -3.1843905 ] [ 4.6187988 -9.4861456 3.8738151 ] [ 6.7459588 7.0558808 0.842924 ] [ -6.3152104 2.0628244 -13.4127196 ] [ 5.1568471 1.2340561 8.6450977 ] [ -3.3889077 9.9328677 2.9164607 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.838914958397559e-08 -1.082438000073514e-08 5.107940983447883e-10 ] [ 7.466331850847484e-09 -6.478299962015731e-09 -5.101956052631577e-09 ] [ 7.400131514507239e-09 -1.519848082704191e-08 6.206536037656372e-09 ] [ 1.080821756328668e-08 1.130476735004922e-08 1.350513137037816e-09 ] [ -1.011808254167379e-08 3.305009053725069e-09 -2.148954594151383e-08 ] [ 8.262179928730662e-09 1.977175848465168e-09 1.385097353358714e-08 ] [ -5.429628731722681e-09 1.591420853755332e-08 4.672685187519283e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9308438 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.430878925826377e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4644503 2.1524792 2.6528092 ] [ 6.0754945 2.1369701 2.0256869 ] [ 4.5117768 1.3246177 3.5833892 ] [ 5.1434967 4.2196434 1.490313 ] [ 2.7448412 3.8972596 0.9631926 ] [ 4.4314376 3.1057269 5.1619184 ] [ 3.5254119 4.5117581 3.4756738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464450300000001e-10 2.1524792e-10 2.6528092e-10 ] [ 6.0754945e-10 2.1369701e-10 2.0256869e-10 ] [ 4.5117768e-10 1.3246177e-10 3.5833892e-10 ] [ 5.143496700000001e-10 4.2196434e-10 1.490313e-10 ] [ 2.7448412e-10 3.8972596e-10 9.631926e-11 ] [ 4.4314376e-10 3.1057269e-10 5.161918400000001e-10 ] [ 3.5254119e-10 4.5117581e-10 3.4756738e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.53e-05 -5.5e-05 -1.83e-05 ] [ -7e-06 -2.81e-05 -2.39e-05 ] [ 6.4e-06 4.64e-05 -1.41e-05 ] [ 1.25e-05 -1.05e-05 -1.27e-05 ] [ -1.38e-05 -2.25e-05 -1.31e-05 ] [ -4.39e-05 -6.9e-06 -1e-07 ] [ 3.05e-05 7.66e-05 8.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.45133025002e-14 -8.811971486999999e-14 -2.93198324022e-14 ] [ -1.1215236438e-14 -4.50211634154e-14 -3.82920215526e-14 ] [ 1.02539304576e-14 7.43409958176e-14 -2.25906905394e-14 ] [ 2.0027207925e-14 -1.6822854657e-14 -2.03476432518e-14 ] [ -2.21100375492e-14 -3.6048974265e-14 -2.09885139054e-14 ] [ -7.03355542326e-14 -1.10550187746e-14 -1.602176634e-16 ] [ 4.886638733699999e-14 1.227267301644e-13 1.318591369782e-13 ] ] } "relaxed-potential-energy" { "source-value" -17.677924 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.832315677042782e-18 } }