{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] "source-value" [ 5.37283 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] "source-value" [ -0.256601 5.36059 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] "source-value" [ 0.0433697 -0.246629 5.47376 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.526223134537543e-09 6.204839121262925e-09 -6.709405234439012e-09 ] [ 3.091145043750893e-10 4.913073005506579e-10 1.488846817745374e-09 ] [ 1.666640197137888e-09 4.097591861868947e-09 -3.05665178328169e-09 ] [ -2.683994633690348e-09 -4.395902889289982e-09 1.991634835307699e-09 ] [ 2.844621491679301e-09 1.671357005109523e-09 2.408153812940709e-09 ] [ -1.541849223626369e-09 -4.694952520133205e-09 -1.295229380739867e-09 ] [ -1.009062531669172e-09 2.000324560645932e-09 1.331463886760555e-09 ] [ -4.11169277852627e-09 -5.374564440014798e-09 3.841187205923894e-09 ] ] "source-value" [ [ 2.8250463 3.872756 -4.1876814 ] [ 0.1929341 0.3066499 0.9292651 ] [ 1.040235 2.5575157 -1.907812 ] [ -1.6752177 -2.7437068 1.2430807 ] [ 1.7754731 1.043179 1.5030514 ] [ -0.9623466 -2.9303589 -0.8084186 ] [ -0.6298073 1.2485044 0.8310344 ] [ -2.5663168 -3.3545393 2.3974805 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.67106356589537e-18 "source-value" -35.395995 } }