Dear all pwscf users I have some problem regarding ecutoff in scf run. I did a series of calculation for oxides like lithium oxide silver oxide and copper oxide. To get the energy convergence of the order of meV, the ecuttoff parameters is beyond 100Ry in all the above cases even with upps. Is it ok?
Mayank kumar gupta Contact No- 9869834437 ? ? ? ? ? ? ? ? ? 8097400037 ? ? ? ? ? ? ? ? ?8080458227
