News
Q-Chem Workshop in Washington, D.C. on August 15th, 2009
Q-Chem 3.2 is released
The Ultimate Quantum Solution
to Problems of All Sizes
Q-Chem is a comprehensive ab initio quantum chemistry package. Its capabilities range from the highest performance DFT/HF calculations to high level post-HF correlation methods. Q-Chem tackles a wide range of problems in commercial, academic and government laboratories, including:
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Q-Chem provides users with some distinct advantages:
- Fast DFT calculations with accurate linear scaling algorithms
- A wide range of post-HF correlation methods that are efficient and unique
- Quantum calculations extended with QM/MM and molecular dynamics
- Detailed description in Q-Chem paper
How to Obtain Q-Chem
Q-Chem is available in two ways:
- Stand-alone (LINUX, Mac OS and other UNIX platforms)
- Fully integrated, as the back end of Spartan
For more information about Q-Chem's features, click here.