Download Q-Chem 6.2.2 + License
Q-Chem quantum chemistry software with crack and license is a comprehensive ab initio quantum chemistry software for accurate predictions of molecular structures, reactivities, and vibrational, electronic and NMR spectra. The new release of Q-Chem 6 represents the state-of-the-art of methodology from the highest performance DFT/HF calculations to high level post-HF correlation methods.
Q-Chem’s ab initio molecular dynamics (AIMD) and quasi-classical molecular dynamics (QMD) simulations may pique your interest. For larger systems, Q-Chem also has built-in QM/MM and embedding capabilities, as well as interfaces with popular packages like CHARMM and Amber. Discover reaction pathways, predict protein-ligand binding energies, and model the binding of substrates to active sites.
Key features of Q-Chem Software:
- Fully integrated graphic interface including molecular builder, input generator, contextual help and visualization toolkit (See amazing image below generated with IQmol; multiple copies available free of charge);
- Dispersion-corrected and double hybrid DFT functionals in Qchem;
- Faster algorithms for DFT, HF, and coupled-cluster calculations;
- Structures and vibrations of excited states with TD-DFT;
- Methods for mapping complicated potential energy surfaces;
- Efficient valence space models for strong correlation;
- More choices for excited states, solvation, and charge-transfer;
- Effective Fragment Potential and QM/MM for large systems;
Q-Chem Software license details:
- License type: Single User Lifetime
- Parallel and serial support: Yes
- File size: 220 MB
