{ "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" [ [ 2.371302 1.822431 2.77878 ] [ 1.953583 1.464236 4.887458 ] [ 2.036561 3.993513 4.302634 ] [ 4.621904 2.219697 2.273588 ] [ 4.551448 2.283743 4.505208 ] [ 4.054448 4.223119 3.103646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.371302e-10 1.822431e-10 2.77878e-10 ] [ 1.953583e-10 1.464236e-10 4.887458e-10 ] [ 2.036561e-10 3.993513e-10 4.302634e-10 ] [ 4.621904e-10 2.219697e-10 2.273588e-10 ] [ 4.551448e-10 2.283743e-10 4.505208e-10 ] [ 4.054448e-10 4.223119e-10 3.103646e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8649216 -5.4307777 -8.6122798 ] [ -2.1273689 -2.1679044 3.851046 ] [ -2.1234132 4.9422377 3.6819763 ] [ 4.4216741 -3.9244345 -6.2744371 ] [ 5.4168723 -0.8505416 8.1920714 ] [ 0.2771573 7.4314205 -0.8383767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.396640270344929e-09 -8.701065063701997e-09 -1.37983933473481e-08 ] [ -3.408420715397013e-09 -3.473365745809451e-09 6.170055866825357e-09 ] [ -3.402082985338114e-09 7.918337697376364e-09 5.899176346199687e-09 ] [ 7.084302867816881e-09 -6.287637205760937e-09 -1.005275643030015e-08 ] [ 8.678786156919124e-09 -1.362717866537825e-09 1.312514527300432e-08 ] [ 4.440549463440518e-10 1.190644818443385e-08 -1.343227548163456e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.930396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.695011960885837e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6659508 1.3776475 2.9552586 ] [ 1.6627377 1.0727213 4.7964255 ] [ 1.8739413 4.9213215 4.2126155 ] [ 5.613796 1.4276759 2.3516203 ] [ 5.1650164 2.171131 4.0035178 ] [ 3.6078039 5.0362417 3.5318762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6659508e-10 1.3776475e-10 2.9552586e-10 ] [ 1.6627377e-10 1.0727213e-10 4.7964255e-10 ] [ 1.8739413e-10 4.921321500000001e-10 4.2126155e-10 ] [ 5.613796e-10 1.4276759e-10 2.3516203e-10 ] [ 5.1650164e-10 2.171131e-10 4.0035178e-10 ] [ 3.6078039e-10 5.0362417e-10 3.5318762e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 4.4e-06 -2.66e-05 ] [ -0.0 -4.4e-06 2.66e-05 ] [ 4.49e-05 1.7e-05 -2.28e-05 ] [ -5.58e-05 0.0001011 1.76e-05 ] [ 5.82e-05 -9.23e-05 3.16e-05 ] [ -4.73e-05 -2.58e-05 -2.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 7.04957713152e-15 -4.261789811328e-14 ] [ 0.0 -7.04957713152e-15 4.261789811328e-14 ] [ 7.193773027392e-14 2.72370025536e-14 -3.652962695424e-14 ] [ -8.940145544064e-14 1.6198005636288e-13 2.819830852608e-14 ] [ 9.324667933055999e-14 -1.4788090209984e-13 5.062878121728e-14 ] [ -7.578295416384e-14 -4.133615681664e-14 -4.229746278912e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.352436 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.183431658512826e-18 } }