Emilie Guidez

12PUBLICATIONS
19CO-AUTHORS
Computational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Nonlinear optics and spectroscopyTheoretical quantum chemistryAtomic and molecular physicsProcedural content generation
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Publications (12)

|May 20, 2026
Hierarchical Truncations for Many-Body Expansion Potentials.

|May 14, 2025
Decrypting the Unusual Structure and σ-Hole Interactions of the XC(NO<sub>2</sub>)<sub>3</sub> (X=F, Cl, Br, and I) Compounds Using Quasi-Atomic Orbitals.

Emilie B Guidez

|Apr 09, 2025
Computation of Protein-Ligand Binding Free Energies with a Quantum Mechanics-Based Mining Minima Algorithm.

Megan Schlinsog, Tosaporn Sattasathuchana, Peng Xu

|Dec 07, 2023
Adaptive-Partitioning Multilayer Dynamics Simulations: 2. Implementations of the Permuted and Interpolated Adaptive-Partitioning Gradients.

Anh L Tran, Emilie B Guidez, Hai Lin

|Nov 21, 2023
Quasi-atomic orbital analysis of halogen bonding interactions.

Emilie B Guidez

|Oct 04, 2023
The General Atomic and Molecular Electronic Structure System (GAMESS): Novel Methods on Novel Architectures.

Federico Zahariev, Peng Xu, Bryce M Westheimer

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Frequent Collaborators

5 joint publications

Mark S Gordon

3 joint publications

Hai Lin

2 joint publications

Joani Mato

2 joint publications

Klaus Ruedenberg