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Q-Chem 5.1 User's Manual : Theoretical Background
Q-Chem 5.1 User's Manual : Theoretical Background

Q-Chem 5.1 User's Manual : Dual-Basis Self-Consistent Field Calculations
Q-Chem 5.1 User's Manual : Dual-Basis Self-Consistent Field Calculations

PDF) Fast and accurate Coulomb calculation with Gaussian functions
PDF) Fast and accurate Coulomb calculation with Gaussian functions

Q-Chem 2.0: A High-Performance Ab Initio Electronic Structure Program Package
Q-Chem 2.0: A High-Performance Ab Initio Electronic Structure Program Package

Q-Chem 5.1 User's Manual : Alphabetical Listing of $rem Variables
Q-Chem 5.1 User's Manual : Alphabetical Listing of $rem Variables

QChem Manual | Modern Physics | Computational Chemistry
QChem Manual | Modern Physics | Computational Chemistry

Q–Chem User's Manual
Q–Chem User's Manual

Starting SCF calculations by superposition of atomic densities - Van Lenthe - 2006 - Journal of Computational Chemistry - Wiley Online Library
Starting SCF calculations by superposition of atomic densities - Van Lenthe - 2006 - Journal of Computational Chemistry - Wiley Online Library

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
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 4.3 User's Manual : Dual-Basis Self-Consistent Field Calculations
Q-Chem 4.3 User's Manual : Dual-Basis Self-Consistent Field Calculations

New Methods and Models for Condensed Phase Simulations
New Methods and Models for Condensed Phase Simulations

Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient. - Abstract - Europe PMC
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 : Converging SCF Calculations
Q-Chem 5.1 User's Manual : Converging SCF Calculations

QCLAB
QCLAB

Understanding the many-body expansion for large systems. I. Precision considerations: The Journal of Chemical Physics: Vol 141, No 1
Understanding the many-body expansion for large systems. I. Precision considerations: The Journal of Chemical Physics: Vol 141, No 1

A tiered approach to Monte Carlo sampling with self-consistent field potentials: The Journal of Chemical Physics: Vol 135, No 18
A tiered approach to Monte Carlo sampling with self-consistent field potentials: The Journal of Chemical Physics: Vol 135, No 18

Keywords by Alpha — PSI4 [beta3] documentation
Keywords by Alpha — PSI4 [beta3] documentation

PDF) Q-Chem 3.0: A high-performance quantum chemistry program package for molecular electronic structure calculations CONTRIBUTING AUTHOR LIST | Emil Proynov - Academia.edu
PDF) Q-Chem 3.0: A high-performance quantum chemistry program package for molecular electronic structure calculations CONTRIBUTING AUTHOR LIST | Emil Proynov - Academia.edu

Step Nine: Collaboration with Other Quantum Chemistry Softwares
Step Nine: Collaboration with Other Quantum Chemistry Softwares

Webinar 14: Beyond Critical Points: Ab Initio Dynamics & Sampling in Q-Chem - YouTube
Webinar 14: Beyond Critical Points: Ab Initio Dynamics & Sampling in Q-Chem - YouTube

Release Log for Q-Chem 5.3 | Q-Chem
Release Log for Q-Chem 5.3 | Q-Chem

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
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

Understanding the many-body expansion for large systems. I. Precision considerations: The Journal of Chemical Physics: Vol 141, No 1
Understanding the many-body expansion for large systems. I. Precision considerations: The Journal of Chemical Physics: Vol 141, No 1

Q-Chem 5.1 User's Manual : Converging SCF Calculations
Q-Chem 5.1 User's Manual : Converging SCF Calculations

PDF) Advances in methods and algorithms in a modern quantum chemistry program package
PDF) Advances in methods and algorithms in a modern quantum chemistry program package