Week 3
Monday Febrary 3, in Delfinen at 10.00 a.m.
Lectures on
* Electron-Structure
Calculations, Pseudopotential Planewave (PP-PW) Methods, VASP (MP);
* Introduction to dacapo
(PP-PW) (ES);
* Car-Parrinello
molecular dynamics (CPMD) method (SG).
Monday - Friday:
0) Please, register.
1) Computer exercizes: Now there
are more computer projects available. Look up the booking list to see when
the relevant supervisor is available for a brief introduction, or write
her/him an email.
2) Project: The project list will
successively grow. Have a look now and then to see what the problems are
like. If you have made up your mind: Sign up on the sign-up list.
3) Homework problems have started
to come and more will come.
4) Quiz: The first one delayed
to this week. In the meantime: Read the question list and get familiar
with typical questions!
Friday Febrary 7, in Delfinen at 11.00 - 11.30 a.m. and noon - 1.00 p.m.
Lectures on
* Molecular calculations
(PH);
* Full-potential LAPW
method, brief introduction (SG).
Senast ändrad: 03-01-31
Ansvarig: lundqvist@fy.chalmers.se