{ "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" [ [ -2.7940752 -10.6369938 6.9344605 ] [ -3.3519752 -0.3978238 -4.7623347 ] [ -2.5713992 10.4480044 0.5693782 ] [ -3.170302 0.1891506 1.4827426 ] [ 1.4843095 -3.0067221 -1.4943083 ] [ 6.454379 1.1972186 -9.0308352 ] [ 3.9490632 2.207166 6.3008968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.476601962197084e-09 -1.704234278195455e-08 1.111023049096108e-08 ] [ -5.370456298941404e-09 -6.373839915578151e-10 -7.630101316764582e-09 ] [ -4.119835680983824e-09 1.673954838369553e-08 9.122444404331865e-10 ] [ -5.079383745275481e-09 3.030526691302925e-10 2.375615528384206e-09 ] [ 2.378125978931337e-09 -4.81729985386268e-09 -2.394145822527393e-09 ] [ 1.034105513558248e-08 1.918155650906907e-09 -1.446899302373769e-08 ] [ 6.327096733101634e-09 3.536269763424653e-09 1.009514954303353e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8944901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.104619085055705e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1234424 2.0925064 4.3008515 ] [ 2.1305249 3.3838481 1.2019052 ] [ 2.3458163 5.2203615 3.9064225 ] [ 1.3322393 3.2379619 3.3256641 ] [ 4.175332 1.1645291 2.477291 ] [ 4.3653894 3.2864303 1.6078423 ] [ 4.3673489 4.1281527 3.7902634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1234424e-10 2.0925064e-10 4.300851500000001e-10 ] [ 2.1305249e-10 3.3838481e-10 1.2019052e-10 ] [ 2.3458163e-10 5.2203615e-10 3.906422500000001e-10 ] [ 1.3322393e-10 3.2379619e-10 3.3256641e-10 ] [ 4.175332e-10 1.1645291e-10 2.477291e-10 ] [ 4.3653894e-10 3.2864303e-10 1.6078423e-10 ] [ 4.3673489e-10 4.128152700000001e-10 3.7902634e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 6.6e-06 -1.44e-05 ] [ -7.9e-06 9e-07 -6e-07 ] [ 2.27e-05 -1.29e-05 -2.12e-05 ] [ 3.36e-05 -8e-07 -2.2e-06 ] [ 4.9e-06 2.69e-05 1.47e-05 ] [ -2.98e-05 8.2e-06 2.16e-05 ] [ -2.27e-05 -2.89e-05 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-15 1.057436569728e-14 -2.307134333952e-14 ] [ -1.265719530432e-14 1.44195895872e-15 -9.6130597248e-16 ] [ 3.636940929216e-14 -2.066807840832e-14 -3.396614436096001e-14 ] [ 5.383313445888e-14 -1.28174129664e-15 -3.52478856576e-15 ] [ 7.850665441919999e-15 4.309855109952001e-14 2.355199632576e-14 ] [ -4.774486329984001e-14 1.313784829056e-14 3.460701500928e-14 ] [ -3.636940929216e-14 -4.630290434112001e-14 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }