| E-mail Us |


Announcing Q-Chem 4.2:
An Engine for Innovation!


Q-Chem is a comprehensive ab initio quantum chemistry package for accurate predictions of molecular structures, reactivities, and vibrational, electronic and NMR spectra. The new release of Q-Chem 4 represents the state-of-the-art of methodology from the highest performance DFT/HF calculations to high level post-HF correlation methods:


IQmol

IQmol: The smart choice in molecular visualization software!

The above image, generated in IQmol, shows the lowest unoccupied molecular orbital (LUMO) for the 12-crown-4 ether complexed with a lithium cation. The mesh superimposed on the system shows the total density.

Q-Chem is available a stand-alone package with a fully integrated graphic interface IQmol. It also serves as the back-end of Spartan:



Spartan '14

Spartan '14: The latest addition to Wavefunctionís line of molecular modeling software for research and education!

Spartan '14 represents a significant improvement over previous versions in terms of ease of use, accuracy of results and accessibility in todayís increasingly mobile computer environment. Q-Chem is fully integrated into Spartan, allowing users to take full advantage of the most intuitive user interface in the business. For more information click visit www.wavfun.com.


More About Our Workshops



Q-Chem News & Events

Developer Success Stories

Visit our News Page for more news about our company and our developers.

 

 

 

Content on this page requires a newer version of Adobe Flash Player.

Get Adobe Flash player

HomeHow to BuyFeaturesTechnical SupportWorkshops/WebinarsAbout UsContact UsFree Demo