loading system configuration loading override configuration from /users/willend/mxtest/mctest/../mccodelib/mcxtrace-test/McXtrace_DUAL_A100_DMSC/mccode_config.json INFO: Using directory: "1" INFO: Using existing c-file: ./Pump_probe.c INFO: Using existing binary: ./Pump_probe.out WARNING: Ignoring invalid parameter: "Pump_probe.instr" INFO: === -------------------------------------------------------------------------- WARNING: No preset parameters were found for the device that Open MPI detected: Local host: r6n22 Device name: mlx5_0 Device vendor ID: 0x02c9 Device vendor part ID: 4123 Default device parameters will be used, which may result in lower performance. You can edit any of the files specified by the btl_openib_device_param_files MCA parameter to set values for your device. NOTE: You can turn off this warning by setting the MCA parameter btl_openib_warn_no_device_params_found to 0. -------------------------------------------------------------------------- Simulation 'Pump_probe' (/users/willend/xTESTS/2022-12-01/McXtrace_DUAL_A100_DMSC_5e7/Pump_probe/Pump_probe.instr): running on 2 nodes (master is 'r6n22.esss.dk', MPI version 3.1). Have found 2 GPU devices on rank 0. Will use device 0. Have found 2 GPU devices on rank 1. Will use device 1. [Pump_probe] Initialize [Pump_probe] Initialize Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Fe_bpy_GS_DFT.txt' (Table_Read_Offset) Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Fe_bpy_ES_DFT.txt' (Table_Read_Offset) Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/FormFactors.txt' (Table_Read_Offset) sample: Computing F2(q) for two states: sample: Computing F2(q) for two states: Integrated f2 for state 0= 35905.3, Mu_s=2.85116e-05 Integrated f2 for state 0= 35905.3, Mu_s=2.85116e-05 Integrated f2 for state 1= 34652.4, Mu_s=2.75167e-05 Integrated f2 for state 1= 34652.4, Mu_s=2.75167e-05 *** TRACE end *** Save [Pump_probe] Detector: emon_src_I=7.95775e-12 emon_src_ERR=1.1254e-15 emon_src_N=5e+07 "emon_src.dat" Detector: lmon_src_I=7.95775e-12 lmon_src_ERR=1.1254e-15 lmon_src_N=5e+07 "lmon_src.dat" Detector: psd4pi_I=1.71454e-28 psd4pi_ERR=7.75706e-32 psd4pi_N=4.08153e+07 "4pi.dat" Detector: bananapsd_I=1.70478e-28 bananapsd_ERR=7.75511e-32 bananapsd_N=4.04663e+07 "bananapsd.th" Finally [Pump_probe: 1]. Time: 3 [s] Detector: 1dpsd_I=1.70773e-28 1dpsd_ERR=7.75569e-32 1dpsd_N=4.05729e+07 "linepsd.dat" Finally [Pump_probe: 1]. Time: 3 [s] [r6n22.esss.dk:3410107] 1 more process has sent help message help-mpi-btl-openib.txt / no device params found [r6n22.esss.dk:3410107] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages INFO: Placing instr file copy /users/willend/xTESTS/2022-12-01/McXtrace_DUAL_A100_DMSC_5e7/Pump_probe/Pump_probe.instr in dataset 1