subject:"Re\: \[Wien\] restoring MSR1a"

Re: [Wien] restoring MSR1a

2016-01-20 Thread Luis Ogando

Dear Professor Marks, Thank you very much ! All the best, Luis 2016-01-20 11:37 GMT-02:00 Laurence Marks : > I don't think you need anything more. > > As one caveat, the default save_lapw deletes the case.broyd* files so you > will need to wait

Re: [Wien] restoring MSR1a

2016-01-20 Thread Laurence Marks

I don't think you need anything more. As one caveat, the default save_lapw deletes the case.broyd* files so you will need to wait for the multisecant matrix to be reestablished before the calculation makes much progress, i.e. 4-8 iterations. --- Professor Laurence Marks Department of Materials