Extra : Second Test 2024

 

(1) When Materials Stido reports "Job Faliure", how to deal with it? Please describe based on different Tasks and Properties scenarios.

(2) How to eliminate ficticious imaginary frequencies in phonon dispersion calculations?

(3) Where/How to find one of the major input file of CASTEP <seedname>.cell? After edited it, how to perform calculation based on the changed input file?

(4) How to serach and disply CASTEP built-in keyword and parameters lists?

(5) For a still running job, how to check / read the detail progress in addition to the simple infomation provided in status.txt.