{ "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" [ [ 1.825241 1.571351 1.750599 ] [ 0.5622357 3.903382 1.066374 ] [ 3.055372 3.197946 1.429481 ] [ 3.763641 1.041333 1.110804 ] [ 3.309317 1.461591 3.355414 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.825241e-10 1.571351e-10 1.750599e-10 ] [ 5.622357e-11 3.903382e-10 1.066374e-10 ] [ 3.055372e-10 3.197946e-10 1.429481e-10 ] [ 3.763641e-10 1.041333e-10 1.110804e-10 ] [ 3.309317e-10 1.461591e-10 3.355414e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.945055 -3.3764103 -0.4322264 ] [ 1.2184735 -0.7994057 0.2730229 ] [ 1.9273739 11.6764851 -2.5216412 ] [ 8.0555739 -6.2419387 -6.0206258 ] [ 2.7436337 -1.2587304 8.7014705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.234244109677015e-08 -5.409605644888314e-09 -6.925030329725492e-10 ] [ 1.952209754764349e-09 -1.280789123074259e-09 4.374309073230164e-10 ] [ 3.087993402120117e-09 1.870779144033955e-08 -4.040114576686057e-09 ] [ 1.290645216970668e-08 -1.000068825360675e-08 -9.646105899345298e-09 ] [ 4.395785770179001e-09 -2.016708418770232e-09 1.394129260168089e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4707412 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.036727026988734e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.241686 1.1569924 1.81328 ] [ 1.0851 3.453474 1.1822628 ] [ 3.4402603 3.5919425 1.5436217 ] [ 3.5823296 1.1624947 0.8556648 ] [ 3.1664308 1.8106994 3.3178426 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.241686e-10 1.1569924e-10 1.81328e-10 ] [ 1.0851e-10 3.453474e-10 1.1822628e-10 ] [ 3.4402603e-10 3.5919425e-10 1.5436217e-10 ] [ 3.5823296e-10 1.1624947e-10 8.556648e-11 ] [ 3.1664308e-10 1.8106994e-10 3.3178426e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 7.9e-06 0.0 ] [ 6e-06 -1e-07 -9e-07 ] [ -1.32e-05 1.5e-06 -5.8e-06 ] [ 7.7e-06 -1.8e-06 -2.9e-06 ] [ 4.3e-06 -7.5e-06 9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.69044777984e-15 1.265719530432e-14 0.0 ] [ 9.6130597248e-15 -1.6021766208e-16 -1.44195895872e-15 ] [ -2.114873139456e-14 2.4032649312e-15 -9.292624400640001e-15 ] [ 1.233675998016e-14 -2.88391791744e-15 -4.646312200320001e-15 ] [ 6.889359469440001e-15 -1.2016324656e-14 1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.878088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903079489340503e-18 } }