| 36 |
|
* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
| 37 |
|
* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
| 38 |
|
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
| 39 |
< |
* [4] Vardeman & Gezelter, in progress (2009). |
| 39 |
> |
* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
| 40 |
> |
* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). |
| 41 |
|
*/ |
| 42 |
|
|
| 43 |
|
#include <stdlib.h> |
| 73 |
|
int simError( void ) { |
| 74 |
|
|
| 75 |
|
int myError = 1; |
| 75 |
– |
int isError; |
| 76 |
|
char errorMsg[MAX_SIM_ERROR_MSG_LENGTH]; |
| 77 |
+ |
|
| 78 |
+ |
#ifdef IS_MPI |
| 79 |
+ |
int isError; |
| 80 |
|
char nodeMsg[MAX_SIM_ERROR_MSG_LENGTH]; |
| 81 |
+ |
#endif |
| 82 |
|
|
| 83 |
|
strcpy(errorMsg, "OpenMD "); |
| 84 |
|
switch( painCave.severity ) { |