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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7894 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2012-03-02 17:05:53 +00:00
parent 38f66380d5
commit f68f04c8ee
3 changed files with 56 additions and 11 deletions
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12
src/GPU/gpu_extra.h
View File

@ -71,7 +71,8 @@ Self-explanatory.
E: Could not find/initialize a specified accelerator device
Could not initialize at least one of the devices specified for the gpu package
Could not initialize at least one of the devices specified for the gpu
package
E: Insufficient memory on accelerator
@ -92,13 +93,14 @@ There was a problem initializing an accelerator for the gpu package
E: Accelerator sharing is not currently supported on system
Multiple MPI processes cannot share the accelerator on your system. For NVIDIA
GPUs, see the nvidia-smi command to change this setting.
Multiple MPI processes cannot share the accelerator on your
system. For NVIDIA GPUs, see the nvidia-smi command to change this
setting.
E: GPU particle split must be set to 1 for this pair style.
For this pair style, you cannot run part of the force calculation on the host.
See the package command.
For this pair style, you cannot run part of the force calculation on
the host. See the package command.
E: Unknown error in GPU library

10
src/KIM/pair_kim.cpp
View File

@ -552,13 +552,13 @@ void PairKIM::kim_init()
support_atypes = true;
strcpy(modelfile,"");
strcpy(testfile,"");
char * kim_dir =getenv("KIM_DIR");
char * kim_models_dir = getenv("KIM_MODELS_DIR");
char * current_path = getenv("PWD");
char *kim_dir = getenv("KIM_DIR");
char *kim_models_dir = getenv("KIM_MODELS_DIR");
char *current_path = getenv("PWD");
if (kim_dir == NULL)
error->all(FLERR,"KIM_DIR environement variable is unset");
error->all(FLERR,"KIM_DIR environment variable is unset");
if (current_path == NULL)
error->all(FLERR,"PWD environement variable is unset");
error->all(FLERR,"PWD environment variable is unset");
if (kim_models_dir == NULL) {
strcat(modelfile,kim_dir);strcat(modelfile,"MODELs/");

43
src/KIM/pair_kim.h
View File

@ -110,3 +110,46 @@ class PairKIM : public Pair {
#endif
#endif
/* ERROR/WARNING messages:
E: Illegal ... command
Self-explanatory. Check the input script syntax and compare to the
documentation for the command. You can use -echo screen as a
command-line option when running LAMMPS to see the offending line.
E: Incorrect args for pair coefficients
Self-explanatory. Check the input script or data file.
E: Pair style kim requires newton pair off
This is a current restriction of the KIM library.
E: All pair coeffs are not set
All pair coefficients must be set in the data file or by the
pair_coeff command before running a simulation.
E: KIM neighbor iterator exceeded range
This should not happen. It likely indicates a bug
in the KIM implementation of the interatomic potential
where it is requesting neighbors incorrectly.
E: KIM_DIR environment variable is unset
This environment variable must be set to use pair_style kim.
See the doc page for pair_style kim.
E: PWD environment variable is unset
This environment variable must be set to use pair_style kim.
See the doc page for pair_style kim.
E: KIM initialization failed
This is an error generated by the KIM library.
*/