Re: [QE-users] Dielectric tensor

2018-08-10 Thread Chandler Bennett
in DFT!) — Stefano > > On 10 Aug 2018, at 15:58, Chandler Bennett wrote: > > I am attempting to run ph.x on a converged scf calculation (geometry taken > from a converged vc-relax run). > > However, for the dielectric tensor, I see the following > > ***

[QE-users] Dielectric tensor

2018-08-10 Thread Chandler Bennett
-0.0139 0.0121 0.0209291.291652303297 Can someone help me understand why some of the matrix elements are not being printed correctly? -- Chandler Bennett NCSU Department of Physics Partners III Building, Rm 133 Phone: (919) 291-6597 mcben

[QE-users] Increasing NSX variable

2018-09-03 Thread Chandler Bennett
a bug? -- Chandler Bennett NCSU Department of Physics Partners III Building, Rm 133 Phone: (919) 291-6597 mcben...@ncsu.edu ___ users mailing list users@lists.quantum-espresso.org https://lists.quantum-espresso.org/mailman/listinfo/users