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2020 – today
- 2024
[j6]Anthony Scemama
, Andreas Savin:
Exploring the role of mean-field potentials and short-range wave function behavior in the adiabatic connection. J. Comput. Chem. 45(24, September): 2091-2097 (2024)
2010 – 2019
- 2017
- [c3]Gabriel Hautreux, Alfredo Buttari, Arnaud Beck, Victor Cameo, Dimitri Lecas, Dominique Aubert, Emeric Brun, Eric Boyer, Fausto Malvagi, Gabriel Staffelbach, Isabelle d'Ast, Joeffrey Legaux, Ghislain Lartigue, Gilles Grasseau, Guillaume Latu, Juan Escobar Munoz, Julien Bigot, Julien Derouillat, Matthieu Haefele, Nicolas Renon, Philippe Parnaudeau, Philippe Wautelet, Pierre-Francois Lavallee, Pierre Kestener, Rémi Lacroix, Stéphane Requena, Anthony Scemama, Vincent Moureau, Jean-Matthieu Etancelin, Yann Meurdesoif:
Pre-exascale Architectures: OpenPOWER Performance and Usability Assessment for French Scientific Community. ISC Workshops 2017: 309-324 - 2016
- [j5]Anthony Scemama, Thomas Applencourt, Emmanuel Giner, Michel Caffarel:
Quantum Monte Carlo with very large multideterminant wavefunctions. J. Comput. Chem. 37(20): 1866-1875 (2016) - 2014
- [j4]Elda Rossi, Stefano Evangelisti, Antonio Laganà, Antonio Monari, Sergio Rampino, Marco Verdicchio, Kim K. Baldridge, Gian Luigi Bendazzoli, Stefano Borini, Renzo Cimiraglia, Celestino Angeli, Peter Kallay, Hans Peter Lüthi, Kenneth Ruud, José Sánchez-Marín, Anthony Scemama, Péter G. Szalay, Attila Tajti:
Code interoperability and standard data formats in quantum chemistry and quantum dynamics: The Q5/D5Cost data model. J. Comput. Chem. 35(8): 611-621 (2014) - [i3]Anthony Scemama, Nicolas Renon, Mathias Rapacioli:
A Sparse SCF algorithm and its parallel implementation: Application to DFTB. CoRR abs/1402.2880 (2014) - 2013
- [j3]Anthony Scemama, Michel Caffarel, Emmanuel Oseret, William Jalby:
Quantum monte carlo for large chemical systems: Implementing efficient strategies for petascale platforms and beyond. J. Comput. Chem. 34(11): 938-951 (2013) - 2012
- [c2]Anthony Scemama, Michel Caffarel, Emmanuel Oseret, William Jalby:
QMC=Chem: A Quantum Monte Carlo Program for Large-Scale Simulations in Chemistry at the Petascale Level and beyond. VECPAR 2012: 118-127 - [i2]Anthony Scemama, Michel Caffarel, Emmanuel Oseret, William Jalby:
Quantum Monte Carlo for large chemical systems: Implementing efficient strategies for petascale platforms and beyond. CoRR abs/1209.6630 (2012) - 2011
- [j2]Aurélien de la Lande, Dennis R. Salahub, Jacques Maddaluno, Anthony Scemama, Julien Pilmé, Olivier Parisel, Helene Gerard, Michel Caffarel, Jean-Philip Piquemal:
Spin-driven activation of dioxygen in various metalloenzymes and their inspired models. J. Comput. Chem. 32(6): 1178-1182 (2011)
2000 – 2009
- 2009
- [i1]Anthony Scemama:
IRPF90: a programming environment for high performance computing. CoRR abs/0909.5012 (2009) - 2008
- [c1]Anthony Scemama, Antonio Monari, Celestino Angeli, Stefano Borini, Stefano Evangelisti, Elda Rossi:
Common Format for Quantum Chemistry Interoperability: Q5Cost Format and Library. ICCSA (1) 2008: 1094-1107 - 2007
- [j1]Anthony Scemama, Michel Caffarel, Andreas Savin:
Maximum probability domains from Quantum Monte Carlo calculations. J. Comput. Chem. 28(1): 442-454 (2007)
Coauthor Index
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