IboView: HOMO and LUMO orbitals (ORCA 5.0)

Поделиться
HTML-код
  • Опубликовано: 5 ноя 2024

Комментарии • 9

  • @Organicarivu
    @Organicarivu 2 года назад

    at 1.32 exclamation mark, not an apostrophe. Sorry guys for the mistake.

  • @luciasessa6683
    @luciasessa6683 Год назад +1

    Thank you for your video. I was just looking for a quick way to display HOMO and LUMO after a calculation with Orca

  • @kellymcguire4970
    @kellymcguire4970 6 месяцев назад

    I am using Orca 5.0.3 and I us orca_2mkl to convert the gbw file to a molden file. When I try to open it in Iboview, nothing is displayed. Is there an issue betwee Iboview and Orca 5.0.3 outputs?

  • @-AzrielChristoferSaragih
    @-AzrielChristoferSaragih 11 месяцев назад

    Hello, I got an error with my IboView it said
    "Problem with OpenGL: Error in FFrameBuffer::BlitFrom (..\src\IboView\IvGl.cpp:229)/glBlitFramebuffer(0, 0, pSrc->width(), pSrc->height(), 0, 0, this->width(), this->height(), Layers, Filter): Invalid operation (op not allowed in current state)"
    How do i fix this error??

  • @mondalbijan
    @mondalbijan 2 года назад +1

    Superb Eric! but it's too much of effort to just visualize the orbitals, chemcraft is quite efficient in this regard..

    • @Organicarivu
      @Organicarivu 2 года назад

      Thank you Bijan da. Ofcourse, chemcraft is definitely efficient but that's paid software. IboView and ORCA are free software.

  • @educationpoint778
    @educationpoint778 5 месяцев назад

    Make video using orca

  • @srivignesh100
    @srivignesh100 2 года назад +1

    First view and comment

    • @Organicarivu
      @Organicarivu 2 года назад +1

      How is it Dr? I Just uploaded and I didn't share the video with anyone. Thank you so much, Dr.