#!/bin/sh cat > partialator_merge_check_1.stream << EOF CrystFEL stream format 2.1 Command line: indexamajig -i dummy.lst -o dummy.stream --kraken=prawn ----- Begin chunk ----- Image filename: dummy.h5 photon_energy_eV = 2000.0 --- Begin crystal Cell parameters 27.74398 27.84377 16.90346 nm, 88.53688 91.11774 118.75944 deg astar = -0.0283891 +0.0149254 -0.0257273 nm^-1 bstar = -0.0068281 +0.0403989 -0.0005196 nm^-1 cstar = +0.0406926 +0.0052233 -0.0426520 nm^-1 Reflections measured after indexing h k l I phase sigma(I) counts fs/px ss/px 1 0 0 100.00 - 1.00 1 938.0 629.0 End of reflections --- End crystal --- Begin crystal Cell parameters 27.74398 27.84377 16.90346 nm, 88.53688 91.11774 118.75944 deg astar = -0.0283891 +0.0149254 -0.0257273 nm^-1 bstar = -0.0068281 +0.0403989 -0.0005196 nm^-1 cstar = +0.0406926 +0.0052233 -0.0426520 nm^-1 Reflections measured after indexing h k l I phase sigma(I) counts fs/px ss/px 1 0 0 200.00 - 1.00 1 938.0 629.0 End of reflections --- End crystal ----- End chunk ----- EOF # We merge two patterns, without scaling or partiality, the result should just # be an average. cat > partialator_merge_check_1_ans.hkl << EOF CrystFEL reflection list version 2.0 Symmetry: unknown h k l I phase sigma(I) nmeas 1 0 0 150.00 - 35.36 2 End of reflections EOF cat > partialator_merge_check_1.beam << EOF beam/fluence = 2.0e15 beam/radius = 1.5e-6 beam/photon_energy = 6000.0 beam/bandwidth = 0.0005 beam/divergence = 0.001 profile_radius = 0.005e9 EOF cat > partialator_merge_check_1.geom << EOF 0/min_fs = 0 0/max_fs = 1023 0/min_ss = 0 0/max_ss = 1023 0/corner_x = -512.00 0/corner_y = -512.00 0/fs = x 0/ss = y 0/clen = 70.0e-3 0/res = 13333.3 ; 75 micron pixel size 0/badrow_direction = y 0/adu_per_eV = 1.0 EOF src/partialator -i partialator_merge_check_1.stream \ -o partialator_merge_check_1.hkl \ -g partialator_merge_check_1.geom \ -b partialator_merge_check_1.beam \ --model=unity --iterations=0 --no-scale --no-polarisation diff partialator_merge_check_1.hkl partialator_merge_check_1_ans.hkl if [ $? -ne 0 ]; then exit 1 fi rm -f partialator_merge_check_1.stream partialator_merge_check_1.hkl \ partialator_merge_check_1_ans.hkl partialator_merge_check_1.beam \ partialator_merge_check_1.geom scaling-report.pdf partialator.params exit 0