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Accelerating the Convergence of Self-Consistent Field Calculations Using  the Many-Body Expansion | Journal of Chemical Theory and Computation
Accelerating the Convergence of Self-Consistent Field Calculations Using the Many-Body Expansion | Journal of Chemical Theory and Computation

12.1.1 Overview‣ 12.1 Introduction ‣ Chapter 12 Fragment-Based Methods ‣ Q- Chem 6.0 User's Manual
12.1.1 Overview‣ 12.1 Introduction ‣ Chapter 12 Fragment-Based Methods ‣ Q- Chem 6.0 User's Manual

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

Q-Chem 5: Facilitating Worldwide Scientific Breakthroughs
Q-Chem 5: Facilitating Worldwide Scientific Breakthroughs

3.1.1 Overview‣ 3.1 IQmol ‣ Chapter 3 Q-Chem Inputs ‣ Q-Chem 5.4 User's  Manual
3.1.1 Overview‣ 3.1 IQmol ‣ Chapter 3 Q-Chem Inputs ‣ Q-Chem 5.4 User's Manual

PDF) σ-SCF: A Direct Energy-targeting Method To Mean-field Excited States
PDF) σ-SCF: A Direct Energy-targeting Method To Mean-field Excited States

Assessment of Initial Guesses for Self-Consistent Field Calculations.  Superposition of Atomic Potentials: Simple yet Efficient | Journal of  Chemical Theory and Computation
Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient | Journal of Chemical Theory and Computation

Multilevel approach to the initial guess for self‐consistent field  calculations - Hégely - 2022 - International Journal of Quantum Chemistry -  Wiley Online Library
Multilevel approach to the initial guess for self‐consistent field calculations - Hégely - 2022 - International Journal of Quantum Chemistry - Wiley Online Library

Q-Chem 6.0 User's Manual
Q-Chem 6.0 User's Manual

8.16.2 The fit-HWMB ECP at a Glance‣ 8.16 A Brief Guide to Q-Chem's  Built-In ECPs ‣ Chapter 8 Basis Sets and Effective Core Potentials ‣ Q-Chem  6.0 User's Manual
8.16.2 The fit-HWMB ECP at a Glance‣ 8.16 A Brief Guide to Q-Chem's Built-In ECPs ‣ Chapter 8 Basis Sets and Effective Core Potentials ‣ Q-Chem 6.0 User's Manual

Triplet energy transfer - Questions - Q-Chem Talk
Triplet energy transfer - Questions - Q-Chem Talk

Accelerating the Convergence of Self-Consistent Field Calculations Using  the Many-Body Expansion | Journal of Chemical Theory and Computation
Accelerating the Convergence of Self-Consistent Field Calculations Using the Many-Body Expansion | Journal of Chemical Theory and Computation

8.16.8 The SRSC ECP at a Glance‣ 8.16 A Brief Guide to Q-Chem's Built-In  ECPs ‣ Chapter 8 Basis Sets and Effective Core Potentials ‣ Q-Chem 5.4  User's Manual
8.16.8 The SRSC ECP at a Glance‣ 8.16 A Brief Guide to Q-Chem's Built-In ECPs ‣ Chapter 8 Basis Sets and Effective Core Potentials ‣ Q-Chem 5.4 User's Manual

Multicomponent Quantum Chemistry: Integrating Electronic and Nuclear  Quantum Effects via the Nuclear–Electronic Orbital Method | Chemical Reviews
Multicomponent Quantum Chemistry: Integrating Electronic and Nuclear Quantum Effects via the Nuclear–Electronic Orbital Method | Chemical Reviews

The oxygen dissociation curve calculated by wB97M-V is not smooth -  Questions - Q-Chem Talk
The oxygen dissociation curve calculated by wB97M-V is not smooth - Questions - Q-Chem Talk

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

Q-Chem 6.0 User's Manual
Q-Chem 6.0 User's Manual

1.3.1 Overview ofQ-ChemFeatures‣ 1.3 Q-Chem Features ‣ Chapter 1  Introduction ‣ Q-Chem 5.4 User's Manual
1.3.1 Overview ofQ-ChemFeatures‣ 1.3 Q-Chem Features ‣ Chapter 1 Introduction ‣ Q-Chem 5.4 User's Manual

Assessment of Initial Guesses for Self-Consistent Field Calculations.  Superposition of Atomic Potentials: Simple yet Efficient | Journal of  Chemical Theory and Computation
Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient | Journal of Chemical Theory and Computation

Q-Chem 5.1 User's Manual
Q-Chem 5.1 User's Manual

Diagonalization-free initial guess to SCF calculations for large molecules  - ScienceDirect
Diagonalization-free initial guess to SCF calculations for large molecules - ScienceDirect

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

Triplet energy transfer - Questions - Q-Chem Talk
Triplet energy transfer - Questions - Q-Chem Talk

Release Log for Q-Chem 5.4 | Q-Chem
Release Log for Q-Chem 5.4 | Q-Chem

Multilevel approach to the initial guess for self‐consistent field  calculations - Hégely - 2022 - International Journal of Quantum Chemistry -  Wiley Online Library
Multilevel approach to the initial guess for self‐consistent field calculations - Hégely - 2022 - International Journal of Quantum Chemistry - Wiley Online Library

6.1.1 Overview‣ 6.1 Introduction ‣ Chapter 6 Wave Function-Based  Correlation Methods ‣ Q-Chem 5.4 User's Manual
6.1.1 Overview‣ 6.1 Introduction ‣ Chapter 6 Wave Function-Based Correlation Methods ‣ Q-Chem 5.4 User's Manual