Information for PSI3 Users
Documentation
| PSI3 Installation Manual: |
PDF (72 kB) |
HTML |
| PSI3 User's Manual: |
PDF (268 kB) |
HTML (single-page) |
HTML (multi-page) |
Citation
"PSI3: An Open-Source Ab Initio Electronic Structure Package,"
T. Daniel Crawford,
C. David Sherrill,
Edward F. Valeev,
Justin T. Fermann,
Rollin A. King,
Matthew L. Leininger,
Shawn T. Brown,
Curtis L. Janssen,
Edward T. Seidl,
Joseph P. Kenny, and
Wesley D. Allen,
J. Comp. Chem. 28, 1610-1616
(2007).
(
doi:10.1002/jcc.20573)
Bug Reports
The
Sourceforge
repository provides a
bug-reporting
system for PSI3.
If you discover a potential error in the program, please submit the bug report and we will do our best to fix it in a subsequent release. Thank you!
Registration
We kindly request that users
subscribe
to the
psicode-users mailing list. This list will be used exclusively by PSI3 administrators to announce new versions of the package.
Acknowledgments
We wish to acknowledge valuable contributions from:
In addition, the authors would like to thank
Prof. Henry F.
Schaefer, in whose group the PSI package had its origin, for his support
and guidance in the early stages of the program.
This page was last updated on 06 August 2007.