Publications

9 Selected Configuration Interaction for Resonances,
Y. Damour, A. Scemama, F. Kossoski, P. F. Loos.
arXiv:2407.08576 [physics.chem-ph]
8 Stochastically accelerated perturbative triples correction in coupled cluster calculations,
Y. Damour, A. Gallo, A. Scemama.
J. Chem. Phys. 161, 034104 (2024)
7 Go Green: Selected Configuration Interaction as a More Sustainable Alternative for High Accuracy,
P. F. Loos, Y. Damour, A. Ammar, M. Caffarel, F. Kossoski, A. Scemama
arXiv:2402.13111 [physics.chem-ph]
6 State-Specific Coupled-Cluster Methods for Excited States,
Y. Damour, A. Scemama, D. Jacquemin, F. Kossoski, and P. F. Loos.
J. Chem. Theory Comput. 20, 4129 (2024).

1. Ground- and excited-state dipole moments and oscillator strengths of full configuration interaction quality,
  Y. Damour, R. Quintero-Monsebaiz, M. Caffarel, D. Jacquemin, F. Kossoski, A. Scemama, and P. F. Loos.
  J. Chem. Theory Comput. 19, 221 (2023).

1. Hierarchy configuration interaction: combining seniority number and excitation degree,
  F. Kossoski, Y. Damour, and P. F. Loos.
  J. Phys. Chem. Lett. (Open Access) 13, 4342 (2022).

1. Accurate full configuration interaction correlation energy estimates for five- and six-membered rings,
  Y. Damour, M. Veril, F. Kossoski, M. Caffarel, D. Jacquemin, A. Scemama, and P. F. Loos.
  J. Chem. Phys. 155, 134104 (2021).

1. The performance of CIPSI on the ground state electronic energy of benzene,
  P. F. Loos, Y. Damour, and A. Scemama.
  J. Chem. Phys. 153, 176101 (2020).
1. SnCN2: A Carbodiimide with an Innovative Approach for Energy Storage Systems and Phosphors in Modern LED Technology
  C. Braun, L. Mereacre, W. Hua, T. Stürzer, I. Ponomarev, P. Kroll, A. Slabon, Z. Chen, Y. Damour, X. Rocquefelte, J. F. Halet, S. Indris.
  ChemElectroChem 7, 22 (2020).