[QE-users] kpoints.x input file

Rajender Prasad Tiwari rajend57_cns at jnu.ac.in
Fri Jul 12 14:51:49 CEST 2019


Dear All,

I want to generate k-points in
*K_POINTS tpiba | crystal | tpiba_b | crystal_b | tpiba_c | crystal_c *
*nks <https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1108>*
 *xk_x(1) <https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1113>*
  *xk_y(1)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1114>*   *xk_z(1)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1115>*   *wk(1)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1116>*
 *xk_x(2) <https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1113>*
  *xk_y(2)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1114>*   *xk_z(2)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1115>*   *wk(2)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1116>*
 . . .
 *xk_x(nks) <https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1113>*
  *xk_y(nks)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1114>*   *xk_z(nks)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1115>*   *wk(nks)
<https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1116>*

format and I believe this can be done using kpoints.x in QE. I tried to
find document describing the input format, however, I couldn't find it.
Could you kindly help me with kpoints.x input file format or with any
document describing kpoints.x input format?

Many thanks!
-- 
Regards,
*Rajender Tiwari*

*Ph.D. Scholar*
*Special Center for Nano Science*

*Jawaharlal Nehru University, New Delhi*
*#+91-9868970410/ 9873513329*
[image: Image result for jnu]
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