[Pw_forum] new in QE

TIMOTHY UTO timuto at yahoo.com
Wed Feb 11 13:47:18 CET 2015


please am new in QE and am using QE 4.2.3. i was able to calculate BAND and DOS for Si. but not able to calculate the other properties. i need help on how to calculate the other properties and how to use a script in running the program instead of runing it one by one. please i will like to konw why we relax the system first before doing any calculation. thanks 
Uto Oghenekevwe Timothy
Ph.D student
University of Ibadan





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