{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1678371 0.0462148 0.7737703 ] [ -0.4542179 0.3625017 -0.5541929 ] [ -0.7594403 -0.8251701 -2.0383803 ] [ -0.4084684 2.7474629 -2.1973403 ] [ -0.6479913 -1.2908384 -0.4249706 ] [ 0.3023754 0.4091534 0.7975198 ] [ -0.0067663 -2.5346541 1.4526118 ] [ 0.8066717 1.0853298 2.1909821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.871081313938321e-09 7.404427270498319e-11 1.23971669474317e-09 ] [ -7.277373061245485e-10 5.807917535252778e-10 -8.879149151086985e-10 ] [ -1.21675750357795e-09 -1.322068253295443e-09 -3.26584528786591e-09 ] [ -6.544385262073656e-10 4.401920861161878e-09 -3.52052728560655e-09 ] [ -1.038196519895284e-09 -2.068151122749945e-09 -6.808779654569603e-10 ] [ 4.844588005764036e-10 6.555360172016555e-10 1.277767588712353e-09 ] [ -1.08408077586342e-11 -4.060963574292299e-09 2.327340684232681e-09 ] [ 1.292430549049058e-09 1.738890045743893e-09 3.51034032613225e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.073515 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.779614283924851e-18 } }