Abdulrahman Aldossary

6PUBLICATIONS
19CO-AUTHORS
Statistical mechanics in chemistrySemi- and unsupervised learningTheoretical quantum chemistryChemical thermodynamics and energetics
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Publications (6)

|Jan 21, 2025
Second-Generation Energy Decomposition Analysis of Intermolecular Interaction Energies from the Second-Order Mo̷ller-Plesset Theory: An Extensible, Orthogonal Formulation with Useful Basis Set Convergence for All Terms.

Zhenling Wang, Kevin Ikeda, Hengyuan Shen

|Oct 14, 2024
Spiers Memorial Lecture: How to do impactful research in artificial intelligence for chemistry and materials science.

Austin H Cheng, Cher Tian Ser, Marta Skreta

|Sep 02, 2024
Local Second Order Mo̷ller-Plesset Theory with a Single Threshold Using Orthogonal Virtual Orbitals: A Distributed Memory Implementation.

Tianyi Shi, Zhenling Wang, Abdulrahman Aldossary

|Mar 27, 2024
Chemical Bonding and the Role of Node-Induced Electron Confinement.

Alistair J Sterling, Daniel S Levine, Abdulrahman Aldossary

|Feb 15, 2023
Sparsity of the electron repulsion integral tensor using different localized virtual orbital representations in local second-order Møller-Plesset theory.

Zhenling Wang, Abdulrahman Aldossary, Martin Head-Gordon

|Sep 08, 2022
Non-iterative method for constructing valence antibonding molecular orbitals and a molecule-adapted minimum basis.

Abdulrahman Aldossary, Martin Head-Gordon

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Frequent Collaborators

5 joint publications

Martin Head-Gordon

3 joint publications

Zhenling Wang

1 joint publications

Alistair J Sterling

1 joint publications

Daniel S Levine