Dump atom/adios and dump custom/adios command notifications
This commit is contained in:
@ -48,6 +48,7 @@ An alphabetic list of all general LAMMPS commands.
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"dimension"_dimension.html,
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"displace_atoms"_displace_atoms.html,
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"dump"_dump.html,
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"dump adios"_dump_adios.html,
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"dump image"_dump_image.html,
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"dump_modify"_dump_modify.html,
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"dump movie"_dump_image.html,
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@ -32,6 +32,7 @@ Commands :h1
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dimension
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displace_atoms
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dump
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dump_adios
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dump_cfg_uef
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dump_h5md
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dump_image
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@ -13,6 +13,7 @@ dump command :h3
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"dump netcdf"_dump_netcdf.html command :h3
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"dump image"_dump_image.html command :h3
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"dump movie"_dump_image.html command :h3
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"dump adios"_dump_adios.html command :h3
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[Syntax:]
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@ -27,10 +28,12 @@ args = list of arguments for a particular style :l
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{atom} args = none
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{atom/gz} args = none
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{atom/mpiio} args = none
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{atom/adios} args = none, discussed on "dump adios"_dump_adios.html doc page
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{cfg} args = same as {custom} args, see below
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{cfg/gz} args = same as {custom} args, see below
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{cfg/mpiio} args = same as {custom} args, see below
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{custom}, {custom/gz}, {custom/mpiio} args = see below
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{custom/adios} args = same as {custom} args, discussed on "dump adios"_dump_adios.html doc page
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{dcd} args = none
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{h5md} args = discussed on "dump h5md"_dump_h5md.html doc page
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{image} args = discussed on "dump image"_dump_image.html doc page
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@ -653,7 +656,7 @@ package"_Build_package.html doc page for more info.
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[Related commands:]
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"dump h5md"_dump_h5md.html, "dump image"_dump_image.html,
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"dump adios"_dump_adios.html "dump h5md"_dump_h5md.html, "dump image"_dump_image.html,
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"dump molfile"_dump_molfile.html, "dump_modify"_dump_modify.html,
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"undump"_undump.html
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73
doc/src/dump_adios.txt
Normal file
73
doc/src/dump_adios.txt
Normal file
@ -0,0 +1,73 @@
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"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c
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:link(lws,http://lammps.sandia.gov)
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:link(ld,Manual.html)
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:link(lc,Commands_all.html)
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:line
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dump atoms/adios command :h3
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dump custom/adios command :h3
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[Syntax:]
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dump ID group-ID atoms/adios N file.bp :pre
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dump ID group-ID custom/adios N file.bp args :pre
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ID = user-assigned name for the dump :ulb,l
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group-ID = ID of the group of atoms to be imaged :l
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adios = style of dump command (other styles {atom} or {cfg} or {dcd} or {xtc} or {xyz} or {local} or {custom} are discussed on the "dump"_dump.html doc page) :l
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N = dump every this many timesteps :l
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file.bp = name of file/stream to write to :l
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args = same options as in "{dump custom}"_dump.html command :l
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:ule
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[Examples:]
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dump adios1 all atom/adios 100 atoms.bp
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dump 4a all custom/adios 100 dump_adios.bp id v_p x y z
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dump 2 subgroup custom/adios 100 dump_adios.bp mass type xs ys zs vx vy vz :pre
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[Description:]
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Dump a snapshot of atom coordinates every N timesteps in the
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"ADIOS"_adios based "BP" file format, or using different I/O solutions in ADIOS,
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to a stream that can be read on-line by another program.
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ADIOS-BP files are binary, portable and self-describing.
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:link(adios,https://github.com/ornladios/ADIOS2)
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[Use from write_dump:]
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It is possible to use these dump styles with the
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"write_dump"_write_dump.html command. In this case, the sub-intervals
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must not be set at all. The write_dump command can be used to
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create a new file at each individual dump.
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dump 4 all atom/adios 100 dump.bp
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write_dump all atom/adios singledump.bp :pre
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:line
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[Restrictions:]
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The number of atoms per snapshot CAN change with the adios style.
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When using the ADIOS tool 'bpls' to list the content of a .bp file,
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bpls will print "__" for the size of the output table indicating that
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its size is changing every step.
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The {atom/adios} and {custom/adios} dump styles are part of the USER-adios package.
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They are only enabled if LAMMPS was built with that package. See the
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"Build package"_Build_package.html doc page for more info.
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:line
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[Related commands:]
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"dump"_dump.html, "dump_modify"_dump_modify.html, "undump"_undump.html
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:line
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@ -54,3 +54,4 @@ thermo_style custom step temp epair press f_10[3] f_10
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thermo 100
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run 200
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write_dump all atom/adios balance_atom_final.bp
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