{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4824038 -0.1361118 -0.5770134 ] [ 1.2125593 -0.1550921 2.1974426 ] [ -1.7467975 -0.4224803 1.1158214 ] [ 0.1813764 1.5726894 -1.3837229 ] [ 0.1021996 2.5110044 0.8449446 ] [ -0.0375682 -1.3904087 -0.9518145 ] [ -0.1941735 -1.979601 -1.2456577 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.728960965128092e-10 -2.180751455716812e-10 -9.244773869848955e-10 ] [ 1.942734177799396e-09 -2.484849387379914e-10 3.520691188276208e-09 ] [ -2.798678138829615e-09 -6.768880649853101e-10 1.787742974797167e-09 ] [ 2.905970300390376e-10 2.519726209219479e-09 -2.216968498310719e-09 ] [ 1.637418111241464e-10 4.023072577551189e-09 1.353750495144476e-09 ] [ -6.01908922214388e-11 -2.227680330850316e-09 -1.524974951802393e-09 ] [ -3.111002446419989e-10 -3.171670466843034e-09 -1.995763660902182e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.895267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.309096835259128e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6309286 1.8690266 3.7529208 ] [ 2.1097597 3.0198436 1.7688386 ] [ 2.7574422 4.9692631 2.9755857 ] [ 1.0703679 3.6127043 3.8083994 ] [ 4.6555022 1.7057719 2.588434 ] [ 4.3270746 3.8140623 1.6747846 ] [ 4.289018 3.5231182 4.0412771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6309286e-10 1.8690266e-10 3.7529208e-10 ] [ 2.1097597e-10 3.0198436e-10 1.7688386e-10 ] [ 2.7574422e-10 4.969263100000001e-10 2.9755857e-10 ] [ 1.0703679e-10 3.6127043e-10 3.8083994e-10 ] [ 4.6555022e-10 1.7057719e-10 2.588434e-10 ] [ 4.327074600000001e-10 3.8140623e-10 1.6747846e-10 ] [ 4.289018e-10 3.5231182e-10 4.041277100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.62e-05 -3.2e-06 1.5e-06 ] [ 4.63e-05 -1.71e-05 4.86e-05 ] [ 1.84e-05 -2.85e-05 -1.37e-05 ] [ 4.08e-05 -2.66e-05 -1.16e-05 ] [ -4.61e-05 3.15e-05 -1.48e-05 ] [ 1.9e-06 2.25e-05 -6.6e-06 ] [ -5.2e-06 2.14e-05 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.004232683079999e-14 -5.1269652288e-15 2.403264951e-15 ] [ 7.41807781542e-14 -2.73972204414e-14 7.786578441239999e-14 ] [ 2.94800500656e-14 -4.5662034069e-14 -2.19498198858e-14 ] [ 6.53688066672e-14 -4.26178984644e-14 -1.85852489544e-14 ] [ -7.386034282739999e-14 5.046856397099999e-14 -2.37122141832e-14 ] [ 3.0441356046e-15 3.6048974265e-14 -1.05743657844e-14 ] [ -8.331318496799998e-15 3.42865799676e-14 -5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.311464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856431936313217e-18 } }