Running the GEOS-5 SBU Benchmark

Revision as of 07:32, 22 February 2017 by Mathomp4 (talk | contribs)

Build and install the model

First, untar the model tarball in nobackup or swdev; the model alone will break the home quota:

$ tar xf GEOSadas-5_16_5-Benchmark.tar.gz

Next, set up ESMADIR:

$ setenv ESMADIR <directory-to>/GEOSadas-5_16_5-Benchmark/GEOSadas

it is just below the src/ directory.

Go into the src/ directory of your model. Following above:

$ cd $ESMADIR/src

Setup the environment by sourcing the g5_modules file:

$ source g5_modules

To build the model, you have one of two choices. First, you can use the parallel_build.csh script to submit a PBS job that compiles the model:

$ ./parallel_build.csh

or you can interactively build the model using:

$ make install

To capture the install log, we recommend tee'ing the output to a file:

$ make install |& tee make.install.log (on tcsh)
$ make install 2>&1 | tee make.install.log (on bash)

Note you can also build in parallel interactively with:

$ make -j8 pinstall |& tee make.pinstall.log (on tcsh)

where N is the number of parallel processes. From testing, 8 jobs is about as much as is useful. You can use more, but no benefit will accrue.

By default, the Intel Fortran compiler (ifort) is used for the build process. For other compilers, contact matthew.thompson@nasa.gov for instructions to use GCC or PGI compilers.

Monitor build process

The build can be monitored using the utility gmh.pl in the directory Config. From the src directory:

$ Config/gmh.pl -Av make.install.log

outputs the build status as

                          --------
                          Packages
                          --------

         >>>> Fatal Error           .... Ignored Error

 [ok]      Config
 [ok]      GMAO_Shared
 [ok]      |    GMAO_mpeu
 [ok]      |    |    mpi0
 [ok]      |    GMAO_pilgrim
 [ok]      |    GMAO_gfio
 [ok]      |    |    r4
 [ok]      |    |    r8
 [ok]      |    GMAO_perllib
 [ok]      |    MAPL_cfio
 [ok]      |    |    r4
 [ok]      |    |    r8
 [ok]      |    MAPL_Base
 [ok]      |    |    TeX
 [ok]      |    GEOS_Shared
 [ 1] .... .... Chem_Base
 [ok]      |    Chem_Shared
 [ok]      |    GMAO_etc
 [ok]      |    GMAO_hermes
 [ 2] .... .... GFDL_fms
 [ok]      |    GEOS_Util
 [ok]      |    |    post 

                          -------
                          Summary
                          -------

IGNORED mpp_comm_sma.d mpp_transmit_sma.d Chem_AodMod.d (3 files in 2 packages)
All 22 packages compiled successfully.

In case of errors, gmh summarizes exactly where it happens by indicating the package where it occurred. Caveat: it does not work in parallel (output is scrambled). So, if the parallel build fails, rerun it sequentially (it will go quickly and die in the same place) and run gmh on the output for a summary.

Test Build with One-Day Run

To make sure all works, we will first try setting up a simple one-day experiment.

Learn to love tcsh

One preliminary note is that GEOS-5 is, in many ways, a collection of csh/tcsh scripts. If things start going wrong, the answer can often be "change your shell to tcsh and try". Yes, it's not bash/fish/zsh, but it is what it is. I don't think it's entirely necessary for just this automated work, but it could happen.

Setting up a one-day experiment

Go into the model application directory and do a couple of preliminary commands:

$ cd $ESMADIR/src/Applications/GEOSgcm_App

Now you can run create_expt.py:

$ ~mathomp4/bin/create_exp.py -h
usage: create_expt.py [-h] [-v] [-q] [--expdsc EXPDSC] [--expdir EXPDIR]
                      [--horz {a,b,c,d,e,c12,c24,c48,c90,c180,c360,c720,c1440,c2880}]
                      [--vert {72,132}] [--ocean {o1,o2,o3}] [--land {1,2}]
                      [--runoff {yes,no}] [--gocart {A,C}]
                      [--emission {MERRA2,PIESA,CMIP,NR,MERRA2-DD,OPS}]
                      [--history HISTORY] [--account ACCOUNT] [--gpu]
                      expid

Utility to quickly create experiment. At present, it creates an experiment in
the same manner as gcm_setup would with home and experiment directories as
usual.

positional arguments:
  expid                 Experiment ID

optional arguments:
  -h, --help            show this help message and exit
  -v, --verbose         Verbose output
  -q, --quiet           Quietly Setup Experiment (no printing)
  --expdsc EXPDSC       Experiment Description (Default: same as expid)
  --expdir EXPDIR       Experiment Directory Root *NOT CONTAINING EXPID*
                        (Default is what is in ~/.EXPDIRroot:
                        /discover/nobackup/mathomp4 )
  --horz {a,b,c,d,e,c12,c24,c48,c90,c180,c360,c720,c1440,c2880}
                        Horizontal Resolution (Default: c48 on clusters, c12
                        on desktop)
  --vert {72,132}       Vertical Resolution (Default: 72)
  --ocean {o1,o2,o3}    Data Ocean Resolution (Default: o1)
  --land {1,2}          Land Surface Model (Default: 1)
  --runoff {yes,no}     Runoff Routing Model (Default: no)
  --gocart {A,C}        GOCART aerosols: Actual (A) or Climatological (C)
                        (Default: A on clusters, C on desktops)
  --emission {MERRA2,PIESA,CMIP,NR,MERRA2-DD,OPS}
                        GOCART Emissions to use (Default: MERRA2)
  --history HISTORY     History Template (Default: Current)
  --account ACCOUNT     Account Number to Use (Default: g0620 at NCCS, g26141
                        at NAS)
  --gpu                 Setup Experiment to use GPUs

This is a script that attempts to ease setting up a GEOS-5 AGCM run. It has some "smarts" in that it will detect from an experiment ID some information, but you can be explicit (to the point you can specify impossible experiments too).

Your first choice is where you'd like to run the experiment. $NOBACKUP or other disks with space are vital. For example, if you'd like to run the experiment in /discover/nobackup/username/experiment-name, then run the script with --expdir /discover/nobackup/username. To actually create the experiment, run the script and choose a C48 horizontal resolution:

$ ~mathomp4/bin/create_expt.py test-1day-expt --horz c48 --account <ACCOUNTID> --expdir /discover/nobackup/username
Horizontal resolution c48 passed in
Using c48 horizontal resolution 

Assuming default vertical resolution of 72
Using 72 vertical resolution

Assuming default ocean resolution of o1
Using o1 ocean resolution 

Using actual aerosols
 Running gcm_setup...done.

Experiment is located in directory: /discover/nobackup/username/test-1day-expt

If you don't pass in an account-id, you'll get the default of g0620 (the developer's account).

Run a one-day test

To run a test one-day run, go to the experiment directory:

$ cd /discover/nobackup/mathomp4/test-1day-expt
total 96M
-rwxr-xr-x 1 mathomp4 g0620 96M Feb 13 11:11 GEOSgcm.x*
-rwxr-xr-x 1 mathomp4 g0620 573 Feb 13 14:47 CAP.rc*
-rwxr-xr-x 1 mathomp4 g0620 364 Feb 13 14:47 fvcore_layout.rc*
-rw-r--r-- 1 mathomp4 g0620 25K Feb 13 14:47 AGCM.rc
-rwxr-xr-x 1 mathomp4 g0620 21K Feb 13 14:47 gcm_run.j*
-rw-r--r-- 1 mathomp4 g0620 61K Feb 13 14:47 HISTORY.rc
drwxr-xr-x 2 mathomp4 g0620 512 Feb 13 14:47 post/
drwxr-xr-x 2 mathomp4 g0620 512 Feb 13 14:47 plot/
drwxr-xr-x 2 mathomp4 g0620 512 Feb 13 14:47 archive/
drwxr-xr-x 2 mathomp4 g0620 512 Feb 13 14:47 regress/
drwxr-xr-x 2 mathomp4 g0620 512 Feb 13 14:47 convert/
drwxr-xr-x 2 mathomp4 g0620 512 Feb 13 14:47 forecasts/
drwxr-xr-x 2 mathomp4 g0620 16K Feb 13 14:47 RC/
Directory: /discover/nobackup/mathomp4/test-1day-expt

Now you'll run another script called makeoneday.bash that edits some .rc files, edits run scripts, as well as linking in some example restarts and sets up the model to stop after one day (with no options). Note: these restarts are write-protected, so if you want to run a multi-year run, don't use this script!

$ ~mathomp4/bin/makeoneday.bash
Using Heracles-5_0 directories
Making one-day experiment 

Restoring AGCM.rc.save to AGCM.rc...
Copying AGCM.rc to AGCM.rc.save...
Restoring CAP.rc.save to CAP.rc...
Copying CAP.rc to CAP.rc.save...
Restoring HISTORY.rc.save to HISTORY.rc...
Copying HISTORY.rc to HISTORY.rc.save...
Restoring gcm_run.j.save to gcm_run.j...
Copying gcm_run.j to gcm_run.j.save...
Restoring regress/gcm_regress.j.save to regress/gcm_regress.j...
Copying regress/gcm_regress.j to regress/gcm_regress.j.save...
Restoring RC/GEOS_ChemGridComp.rc.save to RC/GEOS_ChemGridComp.rc...
Copying RC/GEOS_ChemGridComp.rc to RC/GEOS_ChemGridComp.rc.save...
DYN_INTERNAL_RESTART_TYPE not found. Assuming NC4
Found fvcore_internal_rst. Assuming you have needed restarts!
Changes made to CAP.rc:
9,10c9,10
< JOB_SGMT:     00000015 000000
< NUM_SGMT:     20
---
> JOB_SGMT:     00000001 000000
> NUM_SGMT:     1
25c25
< MAPL_ENABLE_TIMERS: NO
---
> MAPL_ENABLE_TIMERS: YES


Changes made to gcm_run.j:
7c7
< #PBS -l walltime=12:00:00
---
> #PBS -l walltime=0:15:00
11a12
> #SBATCH --mail-type=ALL
260c261
< if($numrs == 0) then
---
> if($numrs == 1) then
433a435
> exit

At this point, you should be able to sbatch gcm_run.j and the model should run a day.

Benchmark Run

The full benchmark run is a run of 5-days using the GMAO Ops setup. This will use space and cores. For effective benchmarking of I/O, it's recommended to run on less congested than nobackup.

Setting up benchmark experiment

Go into the model application directory and do a couple of preliminary commands:

$ cd $ESMADIR/src/Applications/GEOSgcm_App

These echos set up some defaults. While they both don't have to be in the same location, it's highly recommended they are and the use of the script below assumes they are. Also, make sure they are in a nobackup directory.

To actually create the experiment, run the create_expy.py and choose a C720 horizontal resolution with OPS emissions:

$ ~mathomp4/bin/create_expt.py test-1day-expt --horz c720 --emission OPS --account <ACCOUNTID> --expdir <root-for-experiment>
Found c720 horizontal resolution in experiment name
Using c720 horizontal resolution

Assuming default vertical resolution of 72
Using 72 vertical resolution

Assuming default ocean resolution of o1
Horizontal resolution of c720 requires o3 ocean
Using o3 ocean resolution

Using actual aerosols
 Running gcm_setup...done.

Experiment is located in directory: <root-for-experiment>/benchmark-GEOSadas-5_16-5-5day-c720-OpsHistory

Again, if you don't pass in an account-id, you'll get the default of g0620 (the developer's account).

Setup and Run Benchmark

Now change to the experiment directory and run makeoneday.bash to create it with Ops like options:

$ ~mathomp4/bin/makeoneday.bash opsb

The opsb option sets up many things. The run is set for 5 days using 5400 cores, and other flags are tripped to best emulate Ops. It also copies in the Ops HISTORY.rc setup.

NOTE: This will also set the experiment to run in this SLURM environment:

#SBATCH --partition=preops
#SBATCH --qos=benchmark

This is how the script's developer can run 5400-core jobs. Others might have different partition/qos to submit to. Please edit these before sbatch submission.