Need help with Orca, gaussian, gamess.

  • Thread starter Thread starter mukuruku
  • Start date Start date
  • Tags Tags
    Gaussian
Click For Summary
SUMMARY

The discussion focuses on the need for literature and resources related to the computational chemistry programs Orca, Gaussian, and GAMESS for optimizing large quantum systems. Users express difficulty in finding academic literature at their university and suggest that companies provide documentation. Key resources include the official websites for Gaussian and GAMESS, which offer essential documentation for users.

PREREQUISITES
  • Familiarity with quantum chemistry concepts
  • Basic understanding of computational chemistry software
  • Knowledge of optimization techniques in quantum systems
  • Access to documentation from Gaussian and GAMESS
NEXT STEPS
  • Research the official documentation for Gaussian at http://www.gaussian.com/
  • Explore the GAMESS resources available at http://www.msg.ameslab.gov/gamess/
  • Study optimization algorithms specific to quantum chemistry
  • Learn about Orca's capabilities and features for large system optimization
USEFUL FOR

Researchers, graduate students, and professionals in computational chemistry seeking to optimize quantum systems using Orca, Gaussian, and GAMESS software.

mukuruku
Messages
2
Reaction score
0
hey can anyone give me some literature on how work with those programs (Orca, gaussian, gamess) ? I need to do optimization on large quantum system with those programs but at my university i can not find any literature.
 
Computer science news on Phys.org

Similar threads

  • · Replies 11 ·
Replies
11
Views
3K
  • · Replies 14 ·
Replies
14
Views
3K
  • · Replies 1 ·
Replies
1
Views
3K
  • · Replies 1 ·
Replies
1
Views
2K
Replies
3
Views
1K
  • · Replies 0 ·
Replies
0
Views
3K
  • · Replies 2 ·
Replies
2
Views
2K
  • · Replies 1 ·
Replies
1
Views
1K
  • · Replies 4 ·
Replies
4
Views
3K
  • · Replies 1 ·
Replies
1
Views
3K