INFO: Using directory: "22" INFO: Using existing c-file: ./Test_Powders.c INFO: Using existing binary: ./Test_Powders.out INFO: === -------------------------------------------------------------------------- WARNING: Linux kernel CMA support was requested via the btl_vader_single_copy_mechanism MCA variable, but CMA support is not available due to restrictive ptrace settings. The vader shared memory BTL will fall back on another single-copy mechanism if one is available. This may result in lower performance. Local host: runnervm6qbrg -------------------------------------------------------------------------- Simulation 'Test_PowderN' (Test_Powders.instr): running on 2 nodes (master is 'runnervm6qbrg', MPI version 3.1). [Test_PowderN] Initialize [Test_PowderN] Initialize ./Test_Powders.c: INFO: Converting NaCl.cif into F2(HKL) list /tmp/fileUpaLZw cif2hkl -o /tmp/fileUpaLZw --mode NUC NaCl.cif Opening input file '/tmp/fileUpaLZw' (Table_Read_Offset) Table from file '/tmp/fileUpaLZw' (block 1) is 353 x 6 (x=1:22), constant step. interpolation: linear '# TITLE Na4 Cl4 [Cubic, Centric (-1 at origin)];# a b ...' PowderN: Pow_PowderN: Reading 353 rows from NaCl.cif PowderN: Pow_PowderN: Read 353 reflections from file 'NaCl.cif' PowderN: Pow_PowderN: Vc=177.504 [Angs] sigma_abs=136.12 [barn] sigma_inc=27.6783 [barn] reflections=NaCl.cif ./Test_Powders.c: INFO: Converting NaCl.cif into F2(HKL) list /tmp/fileW3Q11e cif2hkl -o /tmp/fileW3Q11e --xtal --mode NUC NaCl.cif Opening input file '/tmp/fileW3Q11e' (Table_Read_Offset) Mode: lengths and angles Single_crystal: NaCl.cif structure a=5.62 b=5.62 c=5.62 aa=90 bb=90 cc=90 V0=177.504 Single_crystal: Pow_Single_crystal: Read 11934 reflections from file 'NaCl.cif' Single_crystal: Pow_Single_crystal: Vc=177.504 [Angs] sigma_abs=136.12 [barn] sigma_inc=27.6783 [barn] reflections=NaCl.cif Direct space lattice orientation: a = [0 5.62 3.44126e-16] b = [0 0 5.62] c = [5.62 3.44126e-16 3.44126e-16] Reciprocal space lattice orientation: a* = [-6.8458e-17 1.118 0] b* = [-6.8458e-17 -6.8458e-17 1.118] c* = [1.118 0 0] NCrystal: McStas sample component(s) are using version 4.2.10 of the NCrystal library. *** TRACE end *** Save [Test_PowderN] Detector: Sph_mon_I=2.49983e+08 Sph_mon_ERR=393892 Sph_mon_N=894443 "Sphere.dat" Finally [Test_PowderN: 22]. Time: 1 [s] Detector: psd_mon_I=348263 psd_mon_ERR=15198.2 psd_mon_N=788 "PSD.dat" Finally [Test_PowderN: 22]. Time: 1 [s] [runnervm6qbrg:23524] 1 more process has sent help message help-btl-vader.txt / cma-permission-denied [runnervm6qbrg:23524] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages INFO: Placing instr file copy Test_Powders.instr in dataset 22 INFO: Placing generated c-code copy Test_Powders.c in dataset 22