pyQChem/input_classes.py at master · hauser-group/pyQChem · GitHub
Introduction to IQmol Part I Fazle Rob Shirin
PDF) Q-Chem 3.0: A high-performance quantum chemistry program package for molecular electronic structure calculations CONTRIBUTING AUTHOR LIST | Emil Proynov - Academia.edu
QChem: an engine for innovation
Webinar 42: GPU Computing with Q-Chem and BrianQC | Q-Chem
A tiered approach to Monte Carlo sampling with self-consistent field potentials: The Journal of Chemical Physics: Vol 135, No 18
Spin–flip non-orthogonal configuration interaction: a variational and almost black-box method for describing strongly correlated molecules - Physical Chemistry Chemical Physics (RSC Publishing)
Fast algorithms for ab initio molecular dynamics John
Flow chart of the Wannier–Boys algorithm. Uppercase words refer to the... | Download Scientific Diagram
PDF) Efficient self-consistent DFT calculation of nondynamic correlation based on the B05 method
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Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient. - Abstract - Europe PMC