Anthony Scemama

24PUBLICATIONS
66CO-AUTHORS
Numerical computation and mathematical softwareOrganometallic chemistryComputational complexity and computabilityTheoretical quantum chemistryFormal methods for software
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Publications (24)

|Mar 18, 2026
QMCkl: A kernel library for quantum Monte Carlo applications.

Emiel Slootman, Vijay Gopal Chilkuri, Aurelien Delval

|Feb 18, 2026
Electron-Induced Fragmentation Dynamics of 1-Methylpyrene (C17H12) Dications and Trications: C2Hxq+ Release Pathways.

Eszter Dudás, Mathias Rapacioli, Patrick Moretto-Capelle

|Sep 08, 2025
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water-methane dimer.

Flaviano Della Pia, Benjamin X Shi, Yasmine S Al-Hamdani

|Jul 09, 2025
Optimizing excited states in quantum Monte Carlo: A reassessment of double excitations.

Stuart Shepard, Anthony Scemama, Saverio Moroni

|Oct 25, 2024
Improved modularity and new features in ipie: Toward even larger AFQMC calculations on CPUs and GPUs at zero and finite temperatures.

Tong Jiang, Moritz K A Baumgarten, Pierre-François Loos

|Aug 22, 2024
Compactification of determinant expansions via transcorrelation.

Abdallah Ammar, Anthony Scemama, Pierre-François Loos

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Frequent Collaborators

7 joint publications

Claudia Filippi

7 joint publications

Pierre-François Loos

6 joint publications

Emmanuel Giner

5 joint publications

Abdallah Ammar