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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9963 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2013-05-30 19:18:38 +00:00
parent 26f3ce4266
commit 10d82d2d84
2 changed files with 20 additions and 15 deletions
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5
lib/awpmd/Makefile.openmpi
View File

@ -1,5 +1,9 @@
SHELL = /bin/sh SHELL = /bin/sh
# which file will be copied to Makefile.lammps
EXTRAMAKE = Makefile.lammps.installed
# ------ FILES ------ # ------ FILES ------
SRC = \ SRC = \
@ -46,6 +50,7 @@ SYSLIB =
lib: $(OBJ) lib: $(OBJ)
$(ARCHIVE) $(ARFLAGS) $(LIB) $(OBJ) $(ARCHIVE) $(ARFLAGS) $(LIB) $(OBJ)
@cp $(EXTRAMAKE) Makefile.lammps
# ------ COMPILE RULES ------ # ------ COMPILE RULES ------

30
lib/awpmd/README
View File

@ -19,11 +19,15 @@ links against when using the USER-AWPMD package.
This library must be built with a C++ compiler, before LAMMPS is This library must be built with a C++ compiler, before LAMMPS is
built, so LAMMPS can link against it. built, so LAMMPS can link against it.
Build the library using one of the provided Makefiles or create your Build the library using one of the provided Makefile.* files or create
own, specific to your compiler and system. For example: your own, specific to your compiler and system. For example:
make -f Makefile.g++ make -f Makefile.g++
Note that this library makes MPI calls, so you must build it with the
same MPI library that is used to build LAMMPS, i.e. as specified by
settings in the lammps/src/MAKE/Makefile.machine file you are using.
When you are done building this library, two files should When you are done building this library, two files should
exist in this directory: exist in this directory:
@ -34,8 +38,8 @@ Makefile.lammps is created by the make command, by copying one of the
Makefile.lammps.* files. See the EXTRAMAKE setting at the top of the Makefile.lammps.* files. See the EXTRAMAKE setting at the top of the
Makefile.* files. Makefile.* files.
It is IMPORTANT that you examine the final Makefile.lammps to insure IMPORTANT: You must examine the final Makefile.lammps to insure it is
it is correct for your system, else the LAMMPS build will likely fail. correct for your system, else the LAMMPS build will likely fail.
Makefile.lammps has settings for 3 variables: Makefile.lammps has settings for 3 variables:
@ -48,15 +52,11 @@ You have several choices for these settings:
If the 2 libraries are already installed on your system, the settings If the 2 libraries are already installed on your system, the settings
in Makefile.lammps.installed should work. in Makefile.lammps.installed should work.
If they are not, you can install them yourself, and make If they are not, you can install them yourself, and speficy the
the appropriate settings. appropriate settings accordingly.
If you want to use the version provided with LAMMPS in lib/linalg, If you want to use the minimalist version of these libraries provided
then the settings in Makefile.lammps.linalg should work. Note that in with LAMMPS in lib/linalg, then the settings in Makefile.lammps.linalg
this case you also need to build the linear-algebra in lib/linalg; see should work. Note that in this case you also need to build the
the lib/linalg/README for more details. linear-algebra in lib/linalg; see the lib/linalg/README for more
details.
You can leave these settings blank and specify them in your
src/MAKE/Makefile.machine file instead. In this case you should edit
the Makefile.* to use Makefile.lammps.empty when it creates
Makefile.lammps.