{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5926182 -0.4821914 -0.3467718 ] [ -0.2247558 -0.2133817 0.3848799 ] [ 0.4289794 0.6957164 1.0771186 ] [ 0.0179688 -2.8904282 -1.1570517 ] [ 0.4881906 -1.730883 -0.8583896 ] [ 0.0843314 2.6204671 0.2928426 ] [ -1.3873326 2.0007008 0.6073722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.494790251005786e-10 -7.72555787830821e-10 -5.555896707127335e-10 ] [ -3.600984881492007e-10 -3.418751710465594e-10 6.166455775958419e-10 ] [ 6.873007654848116e-10 1.114660550787141e-09 1.725734238748827e-09 ] [ 2.878919126383104e-11 -4.630976486141027e-09 -1.853801182796896e-09 ] [ 7.821675658143245e-10 -2.773180275940166e-09 -1.375291748657864e-09 ] [ 1.351137974793331e-10 4.198451123195576e-09 4.691855672942861e-10 ] [ -2.222751856993678e-09 3.205476046975857e-09 9.731175389638618e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.050654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.212468907055001e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1538503 2.3529027 1.2867053 ] [ 2.2420592 1.3882973 3.4749113 ] [ 2.1620975 3.7719677 3.279496 ] [ 4.4891046 1.8677396 1.0925977 ] [ 4.6232055 1.4357331 3.431272 ] [ 3.8230193 4.1263547 1.5185941 ] [ 4.5002657 3.7875839 3.7886245 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1538503e-10 2.3529027e-10 1.2867053e-10 ] [ 2.2420592e-10 1.3882973e-10 3.4749113e-10 ] [ 2.1620975e-10 3.7719677e-10 3.279496e-10 ] [ 4.4891046e-10 1.8677396e-10 1.0925977e-10 ] [ 4.6232055e-10 1.4357331e-10 3.431272e-10 ] [ 3.8230193e-10 4.1263547e-10 1.5185941e-10 ] [ 4.5002657e-10 3.7875839e-10 3.7886245e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 -1.48e-05 1.92e-05 ] [ 5.8e-06 2.1e-06 -1.63e-05 ] [ 1.77e-05 -1.4e-06 1.01e-05 ] [ -7.6e-06 1.14e-05 6.3e-06 ] [ -2.54e-05 3.17e-05 -1.52e-05 ] [ 1.06e-05 -1.71e-05 -3.2e-06 ] [ -1.16e-05 -1.18e-05 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68228545184e-14 -2.371221398784e-14 3.076179111936e-14 ] [ 9.292624400640001e-15 3.36457090368e-15 -2.611547891904e-14 ] [ 2.835852618816e-14 -2.24304726912e-15 1.618198387008e-14 ] [ -1.217654231808e-14 1.826481347712e-14 1.009371271104e-14 ] [ -4.069528616832e-14 5.078899887936e-14 -2.435308463616e-14 ] [ 1.698307218048e-14 -2.739722021568e-14 -5.126965186560001e-15 ] [ -1.858524880128e-14 -1.890568412544e-14 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319314854257e-18 } }