Re: [QE-users] hp.x : Error in routine hp_readin (1):

2022-12-01 Thread Paolo Giannozzi
iland *From:* Paolo Giannozzi *Sent:* Thursday, December 1, 2022 8:17 PM *To:* Quantum ESPRESSO users Forum *Cc:* PURINUT SAE-FU *Subject:* Re: [QE-users] hp.x : Error in routine hp_readin (1): On 01/12/2022 11:49, PURINUT SAE-FU wrote: Af

Re: [QE-users] hp.x : Error in routine hp_readin (1):

2022-12-01 Thread Paolo Giannozzi
s, Faculty of Science, Mahidol University, Thailand *From:* users on behalf of Iurii TIMROV via users *Sent:* Tuesday, November 29, 2022 4:46 PM *To:* users@lists.quantum-espresso.org *Subject:* Re: [QE-users] hp.x

Re: [QE-users] hp.x : Error in routine hp_readin (1):

2022-11-29 Thread Iurii TIMROV via users
URINUT SAE-FU Sent: Tuesday, November 29, 2022 9:34:38 AM To: users@lists.quantum-espresso.org Subject: [QE-users] hp.x : Error in routine hp_readin (1): Hello all I'm trying to calculate the Hubbard parameters using the hp.x code in the q-e 6.7 packages. Firstly, the DFT+U calculation is