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Tags: tool:nmst_dft

Questions & Answers (1-4 of 4)

  1. Permission denied message when running single oxygen atom

    Closed | Responses: 0

    I'm attempting to run the single oxygen atom from HW 1.3 in the Atoms to Materials course.  There appears to be a file permission problem when copying a file.   

    I...

    http://nanohub.org/answers/question/1405

  2. Geometery Relaxation in SeqQuest

    Closed | Responses: 0

    Hi,

    When we run geometry relaxation, does simulator relax lattice constants a (and c) beside atoms positions in unit cell. I couldn’t find any output for relaxed lattice...

    http://nanohub.org/answers/question/1079

  3. Problem running SeqQuest with uploaded input deck

    Closed | Responses: 1

    I have a SeqQuest input deck file that I uploaded using the ‘upload’ option on the first tab of...

    http://nanohub.org/answers/question/679

  4. seqquest problem with building input……….

    Closed | Responses: 2

    Dear All, while running a seqquest calculation, I am having error message at creating input deck…….. syntax error in expression “ * 1.889725989 : unexpected...

    http://nanohub.org/answers/question/573

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