{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1266525 -23.8128051 6.4172968 ] [ -15.3944092 22.664537 -5.171541 ] [ 0.3210309 1.100527 2.2904393 ] [ -0.3842648 -0.698162 -0.798117 ] [ 14.7815811 -0.5035174 -2.3034362 ] [ -0.4505905 1.2494205 -0.4346419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.805096295265872e-09 -3.815231960688701e-08 1.028164290169465e-08 ] [ -2.466456251126843e-08 3.631259130265657e-08 -8.285722083708654e-09 ] [ 5.143482025343828e-10 1.763238629959162e-09 3.669688297821518e-09 ] [ -6.156600787563879e-10 -1.11857883393097e-09 -1.278724398063033e-09 ] [ 2.368270365687915e-08 -8.06723806446002e-10 -3.690511627144393e-09 ] [ -7.219255646545824e-10 2.001792314648246e-09 -6.963730906000916e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8545869 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.175729014021948e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3368732 0.9181139 1.1495117 ] [ 0.0136586 3.4189212 0.2994394 ] [ 0.2137924 2.9706741 2.7699209 ] [ 1.8357343 -0.1915258 2.7252028 ] [ 2.3292285 2.4308385 0.3774609 ] [ 2.5259623 2.1156955 2.8149026 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.368732e-11 9.181139e-11 1.1495117e-10 ] [ 1.36586e-12 3.4189212e-10 2.994394e-11 ] [ 2.137924e-11 2.9706741e-10 2.7699209e-10 ] [ 1.8357343e-10 -1.915258e-11 2.7252028e-10 ] [ 2.3292285e-10 2.4308385e-10 3.774609e-11 ] [ 2.5259623e-10 2.1156955e-10 2.8149026e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0004165 -7.67e-05 -0.0003497 ] [ -3.59e-05 2.71e-05 -3.85e-05 ] [ -0.0002259 -4.63e-05 -2.8e-06 ] [ 3.46e-05 8.75e-05 8.6e-06 ] [ -4.61e-05 -9.36e-05 -0.0002055 ] [ 0.0006898 0.0001019 0.000588 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.673065625632e-13 -1.2288694681536e-13 -5.602811642937599e-13 ] [ -5.751814068672e-14 4.341898642368e-14 -6.16837999008e-14 ] [ -3.6193169863872e-13 -7.418077754303999e-14 -4.48609453824e-15 ] [ 5.543531107968001e-14 1.4019045432e-13 1.377871893888e-14 ] [ -7.386034221888001e-14 -1.4996373170688e-13 -3.292472955744e-13 ] [ 1.10518143302784e-12 1.6326179765952e-13 9.420798530304e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.876968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.223335369718974e-18 } }