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  • Tutorial Application Input Files and Parameters
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All the input files for applications in PGA are available in https://iu.box.com/s/9ztdby709kso8siachz16svn2y511nn7
Folder by the application name exists with input files.
For your ease of use few are existing here.
  1. Gaussian Application Input Files
    1. Gaussian Input 1
      Gaussian.com
    2. Gaussian Input 2 
      caco3wat2.com
    3. Gaussian Input 3
      si3s3h3.com
    4. Gaussian Input 4
      ptc2h3.com
    5. Gaussian Input 5
      pxylene.com
    6. Gaussian Input 6
      ch5n2o.com

  2. Espresso Application Input Files
    1. AI_Pseudopotential_File
      Al.pz-vbc.UPF
    2. AI_Primitive_Cell
      Al.sample.in

  3. NWChem Application Input File
    1. Water_Molecule_Input
      water.nw

  4. WRF Input Files
    1. Namelist File - namelist.input
    2. WRF Boundary File - wrfbdy_d01
    3. WRF Initialization File - wrfinput_d01
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