$ ./lmp_1API_PKGintelGranular -help
Large-scale Atomic/Molecular Massively Parallel Simulator - 29 Aug 2024 - Maintenance
Git info (maintenance / stable_29Aug2024_update1-26-g89e442dac1-modified)
Usage example: ./lmp_1API_PKGintelGranular -var t 300 -echo screen -in in.alloy
List of command line options supported by this LAMMPS executable:
-echo none/screen/log/both : echoing of input script (-e)
-help : print this help message (-h)
-in none/filename : read input from file or stdin (default) (-i)
-kokkos on/off ... : turn KOKKOS mode on or off (-k)
-log none/filename : where to send log output (-l)
-mdi '<mdi flags>' : pass flags to the MolSSI Driver Interface
-mpicolor color : which exe in a multi-exe mpirun cmd (-m)
-cite : select citation reminder style (-c)
-nocite : disable citation reminder (-nc)
-nonbuf : disable screen/logfile buffering (-nb)
-package style ... : invoke package command (-pk)
-partition size1 size2 ... : assign partition sizes (-p)
-plog basename : basename for partition logs (-pl)
-pscreen basename : basename for partition screens (-ps)
-restart2data rfile dfile ... : convert restart to data file (-r2data)
-restart2dump rfile dgroup dstyle dfile ...
: convert restart to dump file (-r2dump)
-restart2info rfile : print info about restart rfile (-r2info)
-reorder topology-specs : processor reordering (-r)
-screen none/filename : where to send screen output (-sc)
-skiprun : skip loops in run and minimize (-sr)
-suffix gpu/intel/kk/opt/omp: style suffix to apply (-sf)
-var varname value : set index style variable (-v)
OS: Linux "Ubuntu 22.04.5 LTS" 6.8.0-50-generic x86_64
Compiler: Intel LLVM C++ 202500.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.0.4 (2025.0.4.20241205) with OpenMP not enabled
C++ standard: C++11
MPI v3.1: Intel(R) MPI Library 2021.14 for Linux* OS
Accelerator configuration:
FFT information:
FFT precision = double
FFT engine = mpiFFT
FFT library = KISS
Active compile time flags:
-DLAMMPS_GZIP
-DLAMMPS_PNG
-DLAMMPS_JPEG
-DLAMMPS_FFMPEG
-DLAMMPS_CURL
-DLAMMPS_SMALLBIG
sizeof(smallint): 32-bit
sizeof(imageint): 32-bit
sizeof(tagint): 32-bit
sizeof(bigint): 64-bit
Available compression formats:
Extension: .gz Command: gzip
Extension: .bz2 Command: bzip2
Extension: .zst Command: zstd
Extension: .xz Command: xz
Extension: .lzma Command: xz
Installed packages:
GRANULAR
List of individual style options included in this LAMMPS executable
* Atom styles:
atomic body charge ellipsoid hybrid
line sphere tri
* Integrate styles:
respa verlet
* Minimize styles:
cg fire/old fire hftn quickmin
sd
* Pair styles:
born buck buck/coul/cut coul/cut coul/debye
coul/dsf coul/wolf meam/c reax reax/c
mesont/tpm gran/hertz/history gran/hooke
gran/hooke/history granular hybrid hybrid/omp
hybrid/molecular hybrid/molecular/omp hybrid/overlay
hybrid/overlay/omp hybrid/scaled hybrid/scaled/omp
lj/cut lj/cut/coul/cut lj/expand morse soft
table yukawa zbl zero
* Bond styles:
hybrid zero
* Angle styles:
hybrid zero
* Dihedral styles:
hybrid zero
* Improper styles:
hybrid zero
* KSpace styles:
* Fix styles
adapt add/heat addforce ave/atom ave/chunk
ave/correlate ave/grid ave/histo ave/histo/weight
ave/time aveforce balance box/relax damping/cundall
deform deposit ave/spatial ave/spatial/sphere
lb/pc lb/rigid/pc/sphere reax/c/bonds reax/c/species
dt/reset efield enforce2d evaporate external
freeze gravity halt heat heat/flow
indent langevin lineforce momentum move
nph nph/sphere npt npt/sphere nve
nve/limit nve/noforce nve/sphere nvt nvt/sllod
nvt/sphere pair planeforce pour press/berendsen
press/langevin print property/atom recenter restrain
setforce spring spring/chunk spring/self store/force
store/state temp/berendsen temp/rescale thermal/conductivity
vector viscous wall/gran wall/gran/region
wall/harmonic wall/lj1043 wall/lj126 wall/lj93 wall/morse
wall/reflect wall/region wall/table
* Compute styles:
aggregate/atom angle angle/local angmom/chunk bond
bond/local centro/atom centroid/stress/atom chunk/atom
chunk/spread/atom cluster/atom cna/atom com
com/chunk contact/atom coord/atom count/type mesont
dihedral dihedral/local dipole dipole/chunk displace/atom
erotate/sphere erotate/sphere/atom fabric fragment/atom
global/atom group/group gyration gyration/chunk heat/flux
improper improper/local inertia/chunk ke ke/atom
msd msd/chunk omega/chunk orientorder/atom
pair pair/local pe pe/atom pressure
property/atom property/chunk property/grid property/local rdf
reduce reduce/chunk reduce/region slice stress/atom
temp temp/chunk temp/com temp/deform temp/partial
temp/profile temp/ramp temp/region temp/sphere torque/chunk
vacf vcm/chunk
* Region styles:
block cone cylinder ellipsoid intersect
plane prism sphere union
* Dump styles:
atom cfg custom atom/mpiio cfg/mpiio
custom/mpiio xyz/mpiio grid grid/vtk image
local movie xyz
* Command styles
angle_write balance change_box create_atoms create_bonds
create_box delete_atoms delete_bonds box kim_init
kim_interactions kim_param kim_property kim_query
reset_ids reset_atom_ids reset_mol_ids message server
dihedral_write displace_atoms info minimize read_data
read_dump read_restart replicate rerun run
set velocity write_coeff write_data write_dump
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