Q-Chem 5: Facilitating Worldwide Scientific Breakthroughs
New Methods and Models for Condensed Phase Simulations
Q–Chem User's Manual
PDF) An assessment of initial guesses for self-consistent field calculations. Superposition of Atomic Potentials: simple yet efficient
Understanding the many-body expansion for large systems. I. Precision considerations: The Journal of Chemical Physics: Vol 141, No 1
Q-Chem 2.0: A High-Performance Ab Initio Electronic Structure Program Package
Excited state orbital optimization via minimizing the square of the gradient: General approach and application to singly and doubly excited states via density functional theory – arXiv Vanity
Q-Chem 5.1 User's Manual : Dual-Basis Self-Consistent Field Calculations
Q-Chem User's Manual Version 4.1 July, 2013
Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient. - Abstract - Europe PMC
PDF) Q-Chem 3.0: A high-performance quantum chemistry program package for molecular electronic structure calculations CONTRIBUTING AUTHOR LIST | Emil Proynov - Academia.edu
Approaching the basis set limit for DFT calculations using an environment-adapted minimal basis with perturbation theory: Formulation, proof of concept, and a pilot implementation: The Journal of Chemical Physics: Vol 145, No
QChem Manual | Modern Physics | Computational Chemistry
Release Log for Q-Chem 5.3 | Q-Chem
Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient. - Abstract - Europe PMC
Q-Chem 5.1 User's Manual : Theoretical Background
Q-Chem 5.1 User's Manual : Theoretical Background
Qchem Manual 4.1 | Hartree–Fock Method | Solid State Chemistry
PDF) An assessment of initial guesses for self-consistent field calculations. Superposition of Atomic Potentials: simple yet efficient
Q-Chem 5.1 User's Manual : Converging SCF Calculations
How can we calculate the emission spectrum of a molecule using Gaussian?
Parallelization of SCF calculations within Q-Chem | Request PDF
