{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0934608 -0.232128 0.0227668 ] [ -0.466095 0.2062911 -0.2521813 ] [ 0.9947733 0.2568454 1.3630359 ] [ -0.1671365 0.4251815 -1.2732514 ] [ 0.1821541 -2.4878523 0.1175299 ] [ 0.2708264 0.359877 0.1029819 ] [ -0.2983308 0.0415 -0.3884335 ] [ -0.6096522 1.4302851 0.3075517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.497407087212646e-10 -3.719100546330624e-10 3.647643469042944e-11 ] [ -7.46766512071776e-10 3.305147774991149e-10 -4.040389830629511e-10 ] [ 1.593802524256065e-09 4.115116950400243e-10 2.183824252291087e-09 ] [ -2.677821927823392e-10 6.812158588966752e-10 -2.039973625480869e-09 ] [ 2.918430404028653e-10 -3.985978791063509e-09 1.883036580249619e-10 ] [ 4.339117263754292e-10 5.765865157636416e-10 1.649951925455635e-10 ] [ -4.779786330245606e-10 6.649032976320001e-11 -6.223390724355168e-10 ] [ -9.767705016592857e-10 2.29156934829859e-09 4.927521434272954e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.37765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.828342034964513e-18 } }