Re: [SIESTA-L] WrieWaveFunctions

2006-11-30 Thread Andrei Postnikov
On Wed, 29 Nov 2006, Cherry Y. Yates wrote: | I was using siesta to get wavefunctions. From the | manu, if WriteWaveFunctions is .false., it will | generate a .WFS file, which can be read by the utility | READWFS, but I can not find this file. If | WriteWaveFunctions is .true., it will write |

Re: [SIESTA-L] WrieWaveFunctions

2006-11-30 Thread Riccardo Rurali
Hello Cherry. Cherry Y. Yates wrote: I was using siesta to get wavefunctions. From the manu, if WriteWaveFunctions is .false., it will generate a .WFS file, which can be read by the utility READWFS, but I can not find this file. WriteWaveFunctions .false. (which is the default value for such

[SIESTA-L] WrieWaveFunctions

2006-11-30 Thread Cherry Y. Yates
Dear Siesta developers, I was using siesta to get wavefunctions. From the manu, if WriteWaveFunctions is .false., it will generate a .WFS file, which can be read by the utility READWFS, but I can not find this file. If WriteWaveFunctions is .true., it will write eigenvectors in the main output