forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12415 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
sjplimp
parent
076914c7ab
commit
2011475077
|
|
@ -30,9 +30,9 @@ experienced users.
|
|||
|
||||
<H4><A NAME = "start_1"></A>2.1 What's in the LAMMPS distribution
|
||||
</H4>
|
||||
<P>When you download LAMMPS you will need to unzip and untar the
|
||||
downloaded file with the following commands, after placing the file in
|
||||
an appropriate directory.
|
||||
<P>When you download a LAMMPS tarball you will need to unzip and untar
|
||||
the downloaded file with the following commands, after placing the
|
||||
tarball in an appropriate directory.
|
||||
</P>
|
||||
<PRE>gunzip lammps*.tar.gz
|
||||
tar xvf lammps*.tar
|
||||
|
|
@ -51,21 +51,22 @@ sub-directories:
|
|||
<TR><TD >tools</TD><TD > pre- and post-processing tools
|
||||
</TD></TR></TABLE></DIV>
|
||||
|
||||
<P>If you download one of the Windows executables from the download page,
|
||||
then you get a single file:
|
||||
<P>Note that the <A HREF = "download">download page</A> also has links to download
|
||||
Windows exectubles and installers, as well as pre-built executables
|
||||
for a few specific Linux distributions. It also has instructions for
|
||||
how to download/install LAMMPS for Macs (via Homebrew), and to
|
||||
download and update LAMMPS from SVN and Git repositories, which gives
|
||||
you the same files that are in the download tarball.
|
||||
</P>
|
||||
<PRE>lmp_windows.exe
|
||||
</PRE>
|
||||
<P>Skip to the <A HREF = "#start_6">Running LAMMPS</A> sections for info on how to
|
||||
launch these executables on a Windows box.
|
||||
</P>
|
||||
<P>The Windows executables for serial or parallel only include certain
|
||||
packages and bug-fixes/upgrades listed on <A HREF = "http://lammps.sandia.gov/bug.html">this
|
||||
<P>The Windows and Linux executables for serial or parallel only include
|
||||
certain packages and bug-fixes/upgrades listed on <A HREF = "http://lammps.sandia.gov/bug.html">this
|
||||
page</A> up to a certain date, as
|
||||
stated on the download page. If you want something with more packages
|
||||
or that is more current, you'll have to download the source tarball
|
||||
and build it yourself from source code using Microsoft Visual Studio,
|
||||
as described in the next section.
|
||||
stated on the download page. If you want an executable with
|
||||
non-included packages or that is more current, then you'll need to
|
||||
build LAMMPS yourself, as discussed in the next section.
|
||||
</P>
|
||||
<P>Skip to the <A HREF = "#start_6">Running LAMMPS</A> sections for info on how to
|
||||
launch a LAMMPS Windows executable on a Windows box.
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
|
|
@ -84,27 +85,45 @@ as described in the next section.
|
|||
|
||||
<A NAME = "start_2_1"></A><B><I>Read this first:</I></B>
|
||||
|
||||
<P>Building LAMMPS can be non-trivial. You may need to edit a makefile,
|
||||
there are compiler options to consider, additional libraries can be
|
||||
used (MPI, FFT, JPEG, PNG), LAMMPS packages may be included or
|
||||
excluded, some of these packages use auxiliary libraries which need to
|
||||
be pre-built, etc.
|
||||
<P>If you want to avoid building LAMMPS, read the preceeding section
|
||||
about options available for downloading and installing executables.
|
||||
Details are discussed on the <A HREF = "download">download</A> page.
|
||||
</P>
|
||||
<P>Please read this section carefully. If you are not comfortable with
|
||||
makefiles, or building codes on a Unix platform, or running an MPI job
|
||||
on your machine, please find a local expert to help you. Many
|
||||
compiling, linking, and run problems that users have are often not
|
||||
LAMMPS issues - they are peculiar to the user's system, compilers,
|
||||
libraries, etc. Such questions are better answered by a local expert.
|
||||
<P>Building LAMMPS can be simple or not-so-simple. If MPI is already
|
||||
installed on your machine (or you just want to run LAMMPS in serial)
|
||||
and you can use one of the provided machine Makefiles and the build
|
||||
works on your platform, then it's simple.
|
||||
</P>
|
||||
<P>If you want to do one of these:
|
||||
</P>
|
||||
<UL><LI>use optional LAMMPS features that require additional libraries
|
||||
<LI>use optional packages that require additional libraries
|
||||
<LI>use optional accelerator packages that require special compiler/linker settings
|
||||
<LI>run on a specialized platform like a supercomputer that has its own compilers, settings, or other libs to use
|
||||
</UL>
|
||||
<P>then building LAMMPS is more complicated. You may need to find where
|
||||
auxiliary libraries exist on your machine or install them if they
|
||||
don't. You may need to build additional libraries that are part of
|
||||
the LAMMPS package, before building LAMMPS. You may need to edit a
|
||||
machine Makefile to make it compatible with your system.
|
||||
</P>
|
||||
<P>Please read the following sections carefully. If you are not
|
||||
comfortable with makefiles, or building codes on a Unix platform, or
|
||||
running an MPI job on your machine, please find a local expert to help
|
||||
you. Many compilation, linking, and run problems that users have are
|
||||
often not really LAMMPS issues - they are peculiar to the user's
|
||||
system, compilers, libraries, etc. Such questions are better answered
|
||||
by a local expert.
|
||||
</P>
|
||||
<P>If you have a build problem that you are convinced is a LAMMPS issue
|
||||
(e.g. the compiler complains about a line of LAMMPS source code), then
|
||||
please post a question to the <A HREF = "http://lammps.sandia.gov/mail.html">LAMMPS mail
|
||||
please post the issue to the <A HREF = "http://lammps.sandia.gov/mail.html">LAMMPS mail
|
||||
list</A>.
|
||||
</P>
|
||||
<P>If you succeed in building LAMMPS on a new kind of machine, for which
|
||||
there isn't a similar Makefile for in the src/MAKE directory, send it
|
||||
to the developers and we can include it in the LAMMPS distribution.
|
||||
there isn't a similar machine Makefile included in the src/MAKE
|
||||
directory, then send it to the developers and we can include it in the
|
||||
LAMMPS distribution.
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
|
|
|
|||
|
|
@ -26,9 +26,9 @@ experienced users.
|
|||
|
||||
2.1 What's in the LAMMPS distribution :h4,link(start_1)
|
||||
|
||||
When you download LAMMPS you will need to unzip and untar the
|
||||
downloaded file with the following commands, after placing the file in
|
||||
an appropriate directory.
|
||||
When you download a LAMMPS tarball you will need to unzip and untar
|
||||
the downloaded file with the following commands, after placing the
|
||||
tarball in an appropriate directory.
|
||||
|
||||
gunzip lammps*.tar.gz
|
||||
tar xvf lammps*.tar :pre
|
||||
|
|
@ -45,21 +45,22 @@ potentials: embedded atom method (EAM) potential files
|
|||
src: source files
|
||||
tools: pre- and post-processing tools :tb(s=:)
|
||||
|
||||
If you download one of the Windows executables from the download page,
|
||||
then you get a single file:
|
||||
Note that the "download page"_download also has links to download
|
||||
Windows exectubles and installers, as well as pre-built executables
|
||||
for a few specific Linux distributions. It also has instructions for
|
||||
how to download/install LAMMPS for Macs (via Homebrew), and to
|
||||
download and update LAMMPS from SVN and Git repositories, which gives
|
||||
you the same files that are in the download tarball.
|
||||
|
||||
lmp_windows.exe :pre
|
||||
The Windows and Linux executables for serial or parallel only include
|
||||
certain packages and bug-fixes/upgrades listed on "this
|
||||
page"_http://lammps.sandia.gov/bug.html up to a certain date, as
|
||||
stated on the download page. If you want an executable with
|
||||
non-included packages or that is more current, then you'll need to
|
||||
build LAMMPS yourself, as discussed in the next section.
|
||||
|
||||
Skip to the "Running LAMMPS"_#start_6 sections for info on how to
|
||||
launch these executables on a Windows box.
|
||||
|
||||
The Windows executables for serial or parallel only include certain
|
||||
packages and bug-fixes/upgrades listed on "this
|
||||
page"_http://lammps.sandia.gov/bug.html up to a certain date, as
|
||||
stated on the download page. If you want something with more packages
|
||||
or that is more current, you'll have to download the source tarball
|
||||
and build it yourself from source code using Microsoft Visual Studio,
|
||||
as described in the next section.
|
||||
launch a LAMMPS Windows executable on a Windows box.
|
||||
|
||||
:line
|
||||
|
||||
|
|
@ -78,27 +79,45 @@ This section has the following sub-sections:
|
|||
|
||||
[{Read this first:}] :link(start_2_1)
|
||||
|
||||
Building LAMMPS can be non-trivial. You may need to edit a makefile,
|
||||
there are compiler options to consider, additional libraries can be
|
||||
used (MPI, FFT, JPEG, PNG), LAMMPS packages may be included or
|
||||
excluded, some of these packages use auxiliary libraries which need to
|
||||
be pre-built, etc.
|
||||
If you want to avoid building LAMMPS, read the preceeding section
|
||||
about options available for downloading and installing executables.
|
||||
Details are discussed on the "download"_download page.
|
||||
|
||||
Please read this section carefully. If you are not comfortable with
|
||||
makefiles, or building codes on a Unix platform, or running an MPI job
|
||||
on your machine, please find a local expert to help you. Many
|
||||
compiling, linking, and run problems that users have are often not
|
||||
LAMMPS issues - they are peculiar to the user's system, compilers,
|
||||
libraries, etc. Such questions are better answered by a local expert.
|
||||
Building LAMMPS can be simple or not-so-simple. If MPI is already
|
||||
installed on your machine (or you just want to run LAMMPS in serial)
|
||||
and you can use one of the provided machine Makefiles and the build
|
||||
works on your platform, then it's simple.
|
||||
|
||||
If you want to do one of these:
|
||||
|
||||
use optional LAMMPS features that require additional libraries
|
||||
use optional packages that require additional libraries
|
||||
use optional accelerator packages that require special compiler/linker settings
|
||||
run on a specialized platform like a supercomputer that has its own compilers, settings, or other libs to use :ul
|
||||
|
||||
then building LAMMPS is more complicated. You may need to find where
|
||||
auxiliary libraries exist on your machine or install them if they
|
||||
don't. You may need to build additional libraries that are part of
|
||||
the LAMMPS package, before building LAMMPS. You may need to edit a
|
||||
machine Makefile to make it compatible with your system.
|
||||
|
||||
Please read the following sections carefully. If you are not
|
||||
comfortable with makefiles, or building codes on a Unix platform, or
|
||||
running an MPI job on your machine, please find a local expert to help
|
||||
you. Many compilation, linking, and run problems that users have are
|
||||
often not really LAMMPS issues - they are peculiar to the user's
|
||||
system, compilers, libraries, etc. Such questions are better answered
|
||||
by a local expert.
|
||||
|
||||
If you have a build problem that you are convinced is a LAMMPS issue
|
||||
(e.g. the compiler complains about a line of LAMMPS source code), then
|
||||
please post a question to the "LAMMPS mail
|
||||
please post the issue to the "LAMMPS mail
|
||||
list"_http://lammps.sandia.gov/mail.html.
|
||||
|
||||
If you succeed in building LAMMPS on a new kind of machine, for which
|
||||
there isn't a similar Makefile for in the src/MAKE directory, send it
|
||||
to the developers and we can include it in the LAMMPS distribution.
|
||||
there isn't a similar machine Makefile included in the src/MAKE
|
||||
directory, then send it to the developers and we can include it in the
|
||||
LAMMPS distribution.
|
||||
|
||||
:line
|
||||
|
||||
|
|
|
|||
Loading…
Reference in New Issue