LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2025-03-13 20:32:26 +01:00
Code Issues Releases Wiki Activity

Added Titanium image

Browse Source
This commit is contained in:
Anthony Scemama 2016-10-07 20:58:30 +02:00
parent 69a60559eb
commit bcade01e46
2 changed files with 3 additions and 1 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

4
README.md
View File

@ -7,6 +7,8 @@ Set of quantum chemistry programs and libraries.
For more information, you can visit the [wiki of the project](http://github.com/LCPQ/quantum_package/wiki>), or below for the installation instructions.
[![Frozen-core Full-CI energy of Ti](https://raw.githubusercontent.com/LCPQ/quantum_package/master/data/Titanium.png)](https://raw.githubusercontent.com/LCPQ/quantum_package/master/data/Titanium.png "Convergence of Ti in cc-pv{DTQ}Z")
Demo
====
@ -155,7 +157,7 @@ Program exited with code 139.
#### Why ?
It's caused when we call the DGEM routine of LAPACK.
It's caused when we call the DGEMM routine of LAPACK.
##### Fix

BIN
data/Titanium.png Normal file
View File

Binary file not shown.
Side by Side

After

Width:  |  Height:  |  Size: 54 KiB