{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0648409 0.4375278 -0.6658237 ] [ -0.6392679 -7.3434199 0.753643 ] [ -9.4584554 -1.4179204 -1.6142585 ] [ 1.4842682 7.3484684 3.9580099 ] [ 0.1551662 -0.3460986 0.2804656 ] [ 5.8799152 4.6606915 -0.4479459 ] [ 2.5135327 -3.3392487 -2.2640904 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.038865749075306e-10 7.009968178854251e-10 -1.066767174503426e-09 ] [ -1.024220092246248e-09 -1.176545577743061e-08 1.207469204977662e-09 ] [ -1.515411623561112e-08 -2.271758933751934e-09 -2.586327249935889e-09 ] [ 2.378059828629239e-09 1.177354436616736e-08 6.341430978920676e-09 ] [ 2.486036600265708e-10 -5.545110899801124e-10 4.493554309607903e-10 ] [ 9.420662743341436e-09 7.46725101958241e-09 -7.176884542761005e-10 ] [ 4.027123360734931e-09 -5.350066242254875e-09 -3.627472736143714e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.50322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.843019029976148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8696527 1.1497186 1.6955857 ] [ 3.4859194 2.0596303 3.7428669 ] [ 2.6616624 4.8962674 1.3837155 ] [ 3.3538205 4.3702641 3.5383734 ] [ 4.1078895 0.8927287 5.6189033 ] [ 2.3373531 7.0039438 0.5348604 ] [ 2.3632935 2.8920117 0.2466002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8696527e-10 1.1497186e-10 1.6955857e-10 ] [ 3.4859194e-10 2.0596303e-10 3.7428669e-10 ] [ 2.6616624e-10 4.8962674e-10 1.3837155e-10 ] [ 3.3538205e-10 4.3702641e-10 3.5383734e-10 ] [ 4.1078895e-10 8.927287000000001e-11 5.6189033e-10 ] [ 2.3373531e-10 7.003943800000001e-10 5.348604e-11 ] [ 2.3632935e-10 2.8920117e-10 2.466002e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.39e-05 5.31e-05 -4.12e-05 ] [ -3.11e-05 -7.49e-05 -4.1e-06 ] [ 5.05e-05 -2.97e-05 -8.82e-05 ] [ 1.22e-05 9.82e-05 6.02e-05 ] [ 2.06e-05 1.3e-06 1.07e-05 ] [ -3.57e-05 -1.16e-05 3.46e-05 ] [ 2.74e-05 -3.64e-05 2.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.03355542326e-14 8.507557926539999e-14 -6.600967732079998e-14 ] [ -4.982769331739999e-14 -1.200030298866e-13 -6.568924199399999e-15 ] [ 8.090992001699999e-14 -4.75846460298e-14 -1.413119791188e-13 ] [ 1.95465549348e-14 1.573337454588e-13 9.645103336679999e-14 ] [ 3.300483866039999e-14 2.0828296242e-15 1.71432899838e-14 ] [ -5.719770583379999e-14 -1.85852489544e-14 5.54353115364e-14 ] [ 4.389963977159999e-14 -5.831922947759999e-14 4.470072808859999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.766027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846431333841312e-18 } }