{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43385e-10 0.0 0.0 ] "source-value" [ 5.43385 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] "source-value" [ 0.0231251 5.41563 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] "source-value" [ -0.0358168 0.0829392 5.41654 ] } "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" [ [ 3.203058522672731e-09 -4.082987861752692e-09 -9.199702963163462e-10 ] [ 1.877905289186183e-09 3.226706489378077e-09 2.107008374859817e-09 ] [ 1.796746872241897e-09 -6.011680707859277e-10 -9.72060422829458e-10 ] [ -2.206780078696247e-09 1.209648315451524e-09 8.738320957318445e-10 ] [ -4.153947302981952e-11 1.214256816283594e-09 -3.936400557056486e-10 ] [ -4.02142550683975e-09 2.554359318948179e-09 -3.166853336484203e-09 ] [ 1.183378867359226e-10 -2.928962632480806e-09 1.404247566290258e-09 ] [ -7.263031918355942e-10 -5.918523750419482e-10 1.067436074453737e-09 ] ] "source-value" [ [ 1.9991919 -2.5484006 -0.5742003 ] [ 1.1720963 2.0139518 1.3150912 ] [ 1.1214412 -0.3752196 -0.6067124 ] [ -1.3773638 0.7550031 0.5454031 ] [ -0.0259269 0.7578795 -0.2456908 ] [ -2.5099764 1.5943057 -1.9765944 ] [ 0.0738607 -1.8281147 0.8764624 ] [ -0.4533228 -0.3694052 0.6662412 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.33361e-11 7.45448e-12 1.00028e-11 ] [ 1.34132e-10 1.25343e-10 1.22744e-10 ] [ -6.90566e-12 2.71113e-10 2.67907e-10 ] [ 1.35774e-10 4.108290000000001e-10 3.9369e-10 ] [ 2.76453e-10 -1.5077e-12 2.69424e-10 ] [ 4.18319e-10 1.35081e-10 4.129380000000001e-10 ] [ 2.74151e-10 2.8117e-10 -1.50387e-11 ] [ 4.06649e-10 4.0541e-10 1.2862e-10 ] ] "source-value" [ [ -0.133361 0.0745448 0.100028 ] [ 1.34132 1.25343 1.22744 ] [ -0.0690566 2.71113 2.67907 ] [ 1.35774 4.10829 3.9369 ] [ 2.76453 -0.015077 2.69424 ] [ 4.18319 1.35081 4.12938 ] [ 2.74151 2.8117 -0.150387 ] [ 4.06649 4.0541 1.2862 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.755674192804494e-18 "source-value" -35.924093 } }