diff options
author | Thomas White <taw@physics.org> | 2011-04-26 16:23:29 +0200 |
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committer | Thomas White <taw@physics.org> | 2012-02-22 15:27:24 +0100 |
commit | c3c5ba136d1a4de7ab053f38724ece8c415b110d (patch) | |
tree | 8b83aa7adf56b123620ec01e3fce884af9f1e6fa /src/partial_sim.c | |
parent | 6815bab588d3e995bd1319e23614372aa1a07f0c (diff) |
Work in progress on post refinement
Diffstat (limited to 'src/partial_sim.c')
-rw-r--r-- | src/partial_sim.c | 6 |
1 files changed, 3 insertions, 3 deletions
diff --git a/src/partial_sim.c b/src/partial_sim.c index a9abb55b..2c2493e9 100644 --- a/src/partial_sim.c +++ b/src/partial_sim.c @@ -39,7 +39,7 @@ static void mess_up_cell(UnitCell *cell) double cx, cy, cz; cell_get_cartesian(cell, &ax, &ay, &az, &bx, &by, &bz, &cx, &cy, &cz); - ax += 0.005*ax; + ax += 0.008*ax; cell_set_cartesian(cell, ax, ay, az, bx, by, bz, cx, cy, cz); } @@ -255,7 +255,7 @@ int main(int argc, char *argv[]) /* Alter the cell by a tiny amount */ image.filename = "(simulated 2)"; - new = rotate_cell(cell, deg2rad(0.001), deg2rad(0.0), 0.0); + new = rotate_cell(cell, deg2rad(1.0), deg2rad(0.0), 0.0); cell_free(image.indexed_cell); image.indexed_cell = new; @@ -264,7 +264,7 @@ int main(int argc, char *argv[]) calculate_partials(image.reflections, 0.5, full, sym); /* Give a slightly incorrect cell in the stream */ - //mess_up_cell(image.indexed_cell); + mess_up_cell(image.indexed_cell); write_chunk(ofh, &image, STREAM_INTEGRATED); reflist_free(image.reflections); |