{ "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" [ 5.43385 0 0 ] "si-unit" "m" "si-value" [ 5.43385e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0231251 5.41563 0 ] "si-unit" "m" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0358168 0.0829392 5.41654 ] "si-unit" "m" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9445 -2.445071 -0.4750942 ] [ 2.5333364 2.091189 0.798885 ] [ 1.2141073 -0.6683369 -0.8475463 ] [ -2.8236865 1.4181582 0.4292841 ] [ 0.2498465 2.0945167 0.4634594 ] [ -1.7636442 0.6934646 -1.4825735 ] [ -0.8297162 -1.543001 0.6055467 ] [ -0.5247433 -1.6409196 0.5080388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.1154324391456e-09 -3.917435592396077e-09 -7.611848199176794e-10 ] [ 4.058852352701637e-09 3.350454125474131e-09 1.279954869707808e-09 ] [ 1.945214331202612e-09 -1.070793755997948e-09 -1.357918866905543e-09 ] [ -4.524044494768579e-09 2.272139912635811e-09 6.877889487011693e-10 ] [ 4.002982210887072e-10 3.355785688615167e-09 7.425438153699955e-10 ] [ -2.825669504649519e-09 1.111052769472424e-09 -2.375344600317629e-09 ] [ -1.329351897539017e-09 -2.472160128071021e-09 9.701927655425913e-10 ] [ -8.407314471814407e-10 -2.629043019732487e-09 8.13967887819287e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -218.43936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.499784356545147e-17 } }