publication you should specify
>> that the atomic orbitals were used (without the Lowdin orthogonalization).
>> You can have a look at this paper for more details:
>>
>> https://arxiv.org/abs/2010.13485
>>
>>
>> Greetings,
>>
>> Iurii
>>
>
7;
>>
>> Also I would remove this: electron_phonon= " "
>>
>>
>> Iurii
>>
>>
>> --
>> Dr. Iurii TIMROV
>> Postdoctoral Researcher
>> STI - IMX - THEOS and NCCR - MARVEL
>> Swiss Federal Institute of Technology Lausanne (E
__
From: users on behalf of Dr. K. C.
Bhamu
Sent: Tuesday, December 1, 2020 2:53:06 PM
To: Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Error in routine diropn (34): can't open a connected
unit
Dear Dr. Lurii,
Thank you for the good comment and providing the reference pa
chnology Lausanne (EPFL)
> CH-1015 Lausanne, Switzerland
> +41 21 69 34 881
> http://people.epfl.ch/265334
> --
> *From:* users on behalf of Dr.
> K. C. Bhamu
> *Sent:* Tuesday, December 1, 2020 2:37:16 PM
> *To:* Quantum ESPRESSO users Forum
>
mailto:users-boun...@lists.quantum-espresso.org>>
on behalf of Timrov Iurii mailto:iurii.tim...@epfl.ch>>
Sent: Tuesday, December 1, 2020 1:27:51 PM
To: Quantum Espresso users Forum
Subject: Re: [QE-users] Error in routine diropn (34): can't open a connected
unit
Can you share yo
urii
> *Sent:* Tuesday, December 1, 2020 1:27:51 PM
> *To:* Quantum Espresso users Forum
> *Subject:* Re: [QE-users] Error in routine diropn (34): can't open a
> connected unit
>
>
> Can you share your PW and PH input and output files using Google Drive?
> Did you check whe
41 21 69 34 881
http://people.epfl.ch/265334
From: users on behalf of Timrov
Iurii
Sent: Tuesday, December 1, 2020 1:27:51 PM
To: Quantum Espresso users Forum
Subject: Re: [QE-users] Error in routine diropn (34): can't open a connected
unit
Can you share
From: users on behalf of Dr. K. C.
Bhamu
Sent: Tuesday, December 1, 2020 12:04:50 PM
To: Quantum Espresso users Forum
Subject: [QE-users] Error in routine diropn (34): can't open a connected unit
Dear Users
I am trying to calculate the phonon band structure of Ni(OH)2 slab
Dear Users
I am trying to calculate the phonon band structure of Ni(OH)2 slab on a
well converged scf.
I am using QE version 6.6 (also tried 6.5 and 6.4.1). QE is compiled with
the mkl-2020.2.254 parallel library.
I am getting below error:
Error in routine diropn (34):
can't open a conn
