Search found 43 matches

by mishchenka
Thu Jun 17, 2021 7:16 am
Forum: Running the code
Topic: Modeling of the SiC
Replies: 11
Views: 7365

Re: Modeling of the SiC

Dear H. Lee, Thank you for your response to the letter of June 16, 2021. According to your instructions I executed the command suggested in your letter. The program prompted me to insert the prefix to continue as shown in the screen shot attached to this letter. However, when I entered the prefix, i...
by mishchenka
Wed Jun 16, 2021 6:00 pm
Forum: Running the code
Topic: Modeling of the SiC
Replies: 11
Views: 7365

Re: Modeling of the SiC

Dear Hari and H. Lee, Thank you for your response to the letter of June 12, 2021. According to your instructions I tried to copy the files using the program pp.py. However, I noticed that there are two versions of the pp.py program. The first version is in the examples folder for the SiC material. T...
by mishchenka
Sat Jun 12, 2021 10:11 am
Forum: Running the code
Topic: Modeling of the SiC
Replies: 11
Views: 7365

Modeling of the SiC

Dear all, In order to understand why I could not perform earlier simulation for modified graphene with epw.x program, I tried to perform an example simulation on your site for SiC material using QE-6.7 software package and EPW program at sequential run. The simulation using the input files SiC.scf.i...
by mishchenka
Mon May 17, 2021 9:38 am
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee,

In addition to my previous letter, I am sending you the texts in the attachment.

Best regards,
Mishchenka Valery.
by mishchenka
Mon May 17, 2021 9:19 am
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee,

In addition to my previous letter, I am sending you the texts of files in attachment.

Best regards,
Mishchenka Valery.
by mishchenka
Mon May 17, 2021 9:16 am
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee,

In addition to my previous letter, I am sending you the texts of files in attachment.

Best regards,
Mishchenka Valery.
by mishchenka
Mon May 17, 2021 9:15 am
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee,

In addition to my previous letter, I am sending you the texts of files in attachment.

Best regards,
Mishchenka Valery.
by mishchenka
Mon May 17, 2021 9:11 am
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee, Thank you for your reply, excuse me for many letters. I will try to send you texts of C2H1.scf.in, C2H1.scf.out, C2H1.ph.in, C2H1.ph.out, C2H1.epw.in, C2H1.epw.out files with .tar.gz extension by one or several letters. I was looking at examples of modeling on your website of different ...
by mishchenka
Wed May 05, 2021 1:16 pm
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee,

In addition to my previous letter, I am sending you the texts of files C2H1.nscf.in, C2H1.nscf.out.

Best regards,
Mishchenka Valery.
by mishchenka
Wed May 05, 2021 1:13 pm
Forum: Running the code
Topic: Modeling of the graphene
Replies: 23
Views: 14881

Re: Modeling of the graphene

Dear H. Lee,

In addition to my previous letter, I am sending you the texts of files C2H1.scf.in, C2H1.scf.out, and C2H1.ph.out.

Best regards,
Mishchenka Valery.