Notices
Results 1 to 1 of 1

Thread: How can we retrieve CISD coefficients in Gaussian software?

  1. #1 How can we retrieve CISD coefficients in Gaussian software? 
    New Member
    Join Date
    Sep 2014
    Posts
    1
    I'm using Configuration Interaction (CI) method to simulate small size nano-structures by Gaussian software.
    For a detailed analysis, I need to know the coefficients of the CIS (CISD) wave function, but don't know how these coefficients can be obtained from the Checkpoint file, Can anyone help me?


    Reply With Quote  
     

  2.  
     

Similar Threads

  1. binomial coefficients
    By dejawolf in forum Mathematics
    Replies: 4
    Last Post: September 3rd, 2008, 03:22 AM
  2. Binomial coefficients
    By thyristor in forum Mathematics
    Replies: 7
    Last Post: April 21st, 2008, 06:08 AM
  3. diffusion coefficients
    By Robin Hood in forum Chemistry
    Replies: 0
    Last Post: April 16th, 2008, 07:39 PM
  4. Retrieve a file using MS DOS?
    By Quantime in forum Computer Science
    Replies: 10
    Last Post: January 11th, 2008, 08:45 AM
  5. Antoine Coefficients.
    By nani in forum Chemistry
    Replies: 0
    Last Post: August 3rd, 2005, 08:53 AM
Tags for this Thread

View Tag Cloud

Bookmarks
Bookmarks
Posting Permissions
  • You may not post new threads
  • You may not post replies
  • You may not post attachments
  • You may not edit your posts
  •