Anouar Benali

Anouar Benali

Argonne National Laboratory - Lemont / United States
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 4422001
person_outline Anouar Benali's MOST POPULAR ARTICLES
1-) QMCPACK: an open source ab initio quantum Monte Carlo package for the electronic structure of atoms, molecules and solidsJ Kim, AD Baczewski, TD Beaudet, A Benali, MC Bennett, MA Berrill, ...Journal of Physics: Condensed Matter 30 (19), 195901, 20181942018
2-) Quantum package 2.0: An open-source determinant-driven suite of programsY Garniron, T Applencourt, K Gasperich, A Benali, A Ferté, J Paquier, ...Journal of chemical theory and computation 15 (6), 3591-3609, 2019962019
3-) QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte CarloPRC Kent, A Annaberdiyev, A Benali, MC Bennett, EJ Landinez Borda, ...The Journal of chemical physics 152 (17), 174105, 2020752020
4-) Benchmarks and reliable DFT results for spin gaps of small ligand Fe (II) complexesS Song, MC Kim, E Sim, A Benali, O Heinonen, K BurkeJournal of chemical theory and computation 14 (5), 2304-2311, 2018962018
5-) Phase stability of TiO2 polymorphs from diffusion Quantum Monte CarloY Luo, A Benali, L Shulenburger, JT Krogel, O Heinonen, PRC KentNew Journal of Physics 18 (11), 113049, 2016802016