Webinar 50: "What's New in Q-Chem 5.4"-Available to View | |
| April 27, 2021 | |
| If you missed our webinar, "What's New in Q-Chem 5.4," presented on May 6th by Dr. Evgeny Epifanovsky, it is now available to view. |
Anna Krylov is elected as a Fellow of the Royal Society of Chemistry | |
| April 26, 2021 | |
| It has been announced that Q-Chem President and developer, Prof. Anna Krylov, has been elected as a Fellow of the Royal Society of Chemistry. Congratulations, Anna! |
Webinar 49: Ab-Initio Frenkel Davydov Exciton Model _ A tool to investigate collective excitations in extended systems | |
| April 6, 2021 | |
| Watch Q-Chem's Webinar 49, "Ab-Initio Frenkel Davydov Exciton Model: A tool to investigate collective excitations in extended systems," presented on March 31st by Bushra Alam, Ohio State University. |
Summer at Q-Chem 2021 - Now Accepting Applications | |
| March 4, 2021 | |
| Q-Chem has announced that it is now taking applications for its 2021 Summer at Q-Chem program. Click here to find out more about this year's program and to find out the application procedures. Application is open to graduate students and postdocs who are members of the Q-Chem developer community. |
Congratulations to Marta Lopez Vidal: The 2021 Michael Wormit Award Winner! | |
| March 3, 2021 | |
| Q-Chem is pleased to announce that Marta Lopez Vidal has been chosen as a recipient of the 2021 Michael Wormit Award, on the basis of her scientific innovation, her wealth of exciting new ideas, her impressive code development, and the breadth of her contributions to Q-Chem's infrastructure and to the Q-Chem developers' community. The Michael Wormit award was established to recognize excellence in the development of new methods and algorithms in the area… Read More |
Webinar 48: The ezSpectra Suite: An easy-to-use Toolkit for Spectroscopy Modeling | |
| February 24, 2021 | |
| Watch Q-Chem's Webinar 48, "The ezSpectra Suite: An easy-to-use Toolkit for Spectroscopy Modeling," presented on March 3, 2021 by Dr. Samer Gozem (Georgia State University). |
New Videos from the Wormit Award Webinar Mini-Symposium | |
| December 18, 2020 | |
| Watch the videos from our 2020 Wormit Award virtual event presented on December 2, 2020: |
New Video: "Chemistry doesn't happen in a vacuum: Bringing advanced solvent environments to Q-Chem for dynamics and more" | |
| December 15, 2020 | |
| Watch Q-Chem's November webinar, "Chemistry doesn't happen in a vacuum: Bringing advanced solvent environments to Q-Chem for dynamics and more," co-presented on November 23, 2020 by Dr. Maximilian Menger (University of Groningen) and Dr. Vale Cofer-Shabica (University of Pennsylvania). |
Upgrade Today: Q-Chem 5.3.2 is Released! | |
| December 10, 2020 | |
| Q-Chem is pleased to introduce our latest release, Q-Chem 5.3.2. Its improved performance means that your computational work will run more efficiently so you can be more productive. The Q-Chem 5.3 release log contains a complete list of improvements in the software. Any of our customers who have purchased Q-Chem 5.3 are eligible for this upgrade, free of charge. Update your software today! If you do not have a Q-… Read More |
New Video: "PySurf - A Framework for Database Accelerated Direct Dynamics" | |
| November 9, 2020 | |
| Watch Q-Chem's October webinar, "PySurf - A Framework for Database Accelerated Direct Dynamics," presented on October 28, 2020 by Dr. Maximilian Menger (University of Groningen). |
Q-Chem Webinar 68: Orbital optimized density functional theory for core-level excited states and applications to molecular symmetry breaking |
| May 11, 2023 |
|
Electronic excited states with singly occupied inner shells are challenging to model with traditional linear response methods like time… Read More |
Q-Chem Developer Felix Plasser Awarded EuChemS Walter Thiel Award |
| April 2, 2023 |
|
Congratulations to Q-Chem developer Felix Plasser, who has been awarded the EuChemS Walter Thiel Award in Computational and Theoretical Chemistry! This award is recognizes the exemplary scientific… Read More |
Q-Chem Developer Thomas Jagau Awarded 2023 Dirac Award |
| February 16, 2023 |
|
Q-Chem is very pleased to congratulate Thomas Jagau on his receipt of the prestigious 2023 Dirac Medal! The Dirac Medal is awarded annually to an… Read More |
Q-Chem Developer Debashree Ghosh Awarded 2022 Walter Kohn Prize |
| December 15, 2022 |
|
Q-Chem is pleased to congratulate Debashree Ghosh on being awarded the 2022 Walter Kohn Prize! She is recognized… Read More |
Q-Chem 6.0.2 Is Released |
| December 13, 2022 |
|
Q-Chem is pleased to introduce our latest release, Q-Chem 6.0.2. It includes several bugfixes and improvements to the recent 6.0 release. For a full list of updates, fixes, and resolved issues … Read More |