Saad Yalouz

Publication Activity (10 Years)

Years Active: 2022-2023
Publications (10 Years): 6

Top Topics

Transition Metal

Molecular Dynamics

Convolutional Neural Network

Top Venues

Journal of chemical theory and computation

Chemphyschem : a European journal of chemical physics and physical chemistry

Inorganic chemistry

The Journal of chemical physics

This page only lists publications with an associated author ORCID identifier.

Publications

Saad Yalouz, Vincent Robert
Orthogonally Constrained Orbital Optimization: Assessing Changes of Optimal Orbitals for Orthogonal Multireference States. Journal of chemical theory and computation (2023)
Pablo Roseiro, Saad Yalouz, David J R Brook, Nadia Ben Amor, Vincent Robert
Modifications of Tanabe-Sugano d 6 Diagram Induced by Radical Ligand Field: Ab Initio Inspection of a Fe(II)-Verdazyl Molecular Complex. Inorganic chemistry (2023)
Saad Yalouz, Vincent Robert
Orthogonally Constrained Orbital Optimization: Assessing Changes of Optimal Orbitals for Orthogonal Multireference States. Journal of chemical theory and computation 19 (5) (2023)
Saad Yalouz, Emiel Koridon, Bruno Senjean, Benjamin Lasorne, Francesco Buda, Lucas Visscher
Analytical Nonadiabatic Couplings and Gradients within the State-Averaged Orbital-Optimized Variational Quantum Eigensolver. Journal of chemical theory and computation 18 (2) (2022)
Saad Yalouz, Sajanthan Sekaran, Emmanuel Fromager, Matthieu Saubanère
Quantum embedding of multi-orbital fragments using the block-Householder transformation. The Journal of chemical physics 157 (21) (2022)
Pablo Roseiro, Louis Petit, Vincent Robert, Saad Yalouz
Emergence of Spinmerism for Molecular Spin-Qubits Generation. Chemphyschem : a European journal of chemical physics and physical chemistry (2022)