{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8139529 0.050837 0.5373901 ] [ 0.1519172 0.8901187 -0.7169979 ] [ 0.2551549 0.9924341 -0.0226007 ] [ -0.000501 0.1179134 2.8218013 ] [ -0.0430332 -0.5251759 1.0478298 ] [ 0.4563626 0.2720551 -2.895958 ] [ -0.0059476 -1.7981824 -0.7714647 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.30409630681236e-09 8.144985287160961e-11 8.60993854469374e-10 ] [ 2.433981861373978e-10 1.426127370876889e-09 -1.148757272542696e-09 ] [ 4.08803215462562e-10 1.590054712704689e-09 -3.621031315371456e-11 ] [ -8.026904870208001e-13 1.889180927590387e-10 4.521024071403048e-09 ] [ -6.894678695821056e-11 -8.414245487875989e-10 1.67880840813754e-09 ] [ 7.311734883275021e-10 4.358803207894061e-10 -4.639836202418725e-09 ] [ -9.52910566987008e-12 -2.881005801214034e-09 -1.236022706112486e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.45360908557246 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.354417483828666e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0875339 3.0171972 1.6120535 ] [ 2.4696771 2.6237318 3.8993708 ] [ 3.5622576 1.2966437 2.2425678 ] [ 4.8351834 2.7779225 3.6156505 ] [ 3.1515207 4.9216831 0.7882493 ] [ 4.6143411 3.1819148 1.3089901 ] [ 3.4472533 4.599488 3.078777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0875339e-10 3.0171972e-10 1.6120535e-10 ] [ 2.4696771e-10 2.6237318e-10 3.8993708e-10 ] [ 3.5622576e-10 1.2966437e-10 2.2425678e-10 ] [ 4.8351834e-10 2.7779225e-10 3.6156505e-10 ] [ 3.1515207e-10 4.9216831e-10 7.882493000000001e-11 ] [ 4.6143411e-10 3.1819148e-10 1.3089901e-10 ] [ 3.4472533e-10 4.599488e-10 3.078777e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-05 1.94e-05 4.6e-06 ] [ 2.43e-05 -5.65e-05 3.4e-06 ] [ 2.3e-05 4.16e-05 2.95e-05 ] [ -4.77e-05 -1.05e-05 1.2e-06 ] [ 1.64e-05 4.4e-06 -2.52e-05 ] [ -5.71e-05 9.3e-06 1.41e-05 ] [ 2.81e-05 -7.7e-06 -2.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-14 3.108222644352e-14 7.370012455680001e-15 ] [ 3.893289188544e-14 -9.052297907519999e-14 5.44740051072e-15 ] [ 3.68500622784e-14 6.665054742528e-14 4.72642103136e-14 ] [ -7.642382481215999e-14 -1.68228545184e-14 1.92261194496e-15 ] [ 2.627569658112e-14 7.04957713152e-15 -4.037485084416e-14 ] [ -9.148428504768e-14 1.490024257344e-14 2.259069035328e-14 ] [ 4.502116304448e-14 -1.233675998016e-14 -4.422007473408001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }