Recent developments in the ABINIT software package X Gonze, F Jollet, FA Araujo, D Adams, B Amadon, T Applencourt, ... Computer physics communications 205, 106-131, 2016 | 876 | 2016 |
ABINIT: Overview and focus on selected capabilities AH Romero, DC Allan, B Amadon, G Antonius, T Applencourt, L Baguet, ... The Journal of chemical physics 152 (12), 2020 | 285 | 2020 |
Quantum package 2.0: An open-source determinant-driven suite of programs Y Garniron, T Applencourt, K Gasperich, A Benali, A Ferté, J Paquier, ... Journal of chemical theory and computation 15 (6), 3591-3609, 2019 | 159 | 2019 |
Screened Coulomb interaction calculations: cRPA implementation and applications to dynamical screening and self-consistency in uranium dioxide and cerium B Amadon, T Applencourt, F Bruneval Physical Review B 89 (12), 125110, 2014 | 80 | 2014 |
Communication: Toward an improved control of the fixed-node error in quantum Monte Carlo: The case of the water molecule M Caffarel, T Applencourt, E Giner, A Scemama The Journal of Chemical Physics 144 (15), 2016 | 76 | 2016 |
Quantum Monte Carlo with very large multideterminant wavefunctions A Scemama, T Applencourt, E Giner, M Caffarel Journal of Computational Chemistry 37 (20), 1866-1875, 2016 | 49 | 2016 |
Accurate nonrelativistic ground-state energies of 3d transition metal atoms A Scemama, T Applencourt, E Giner, M Caffarel The Journal of Chemical Physics 141 (24), 2014 | 48 | 2014 |
Using CIPSI nodes in diffusion Monte Carlo M Caffarel, T Applencourt, E Giner, A Scemama Recent progress in quantum monte carlo, 15-46, 2016 | 36 | 2016 |
Toward a systematic improvement of the fixed-node approximation in diffusion Monte Carlo for solids—A case study in diamond A Benali, K Gasperich, KD Jordan, T Applencourt, Y Luo, MC Bennett, ... The Journal of Chemical Physics 153 (18), 2020 | 28 | 2020 |
Performance portability evaluation of opencl benchmarks across intel and nvidia platforms C Bertoni, JH Kwack, T Applencourt, Y Ghadar, B Homerding, C Knight, ... 2020 IEEE International Parallel and Distributed Processing Symposium …, 2020 | 23 | 2020 |
Recent Progress in Quantum Monte Carlo M Caffarel, T Applencourt, E Giner, A Scemama ACS Symp. Ser 1234, 15-46, 2016 | 21 | 2016 |
Quantum package v1. 0 A Scemama, T Applencourt, Y Garniron, E Giner, G David, M Caffarel Zenodo. http://dx. doi. org/10.5281/zenodo 200970, 2016 | 17 | 2016 |
Spin-adapted selected configuration interaction in a determinant basis VG Chilkuri, T Applencourt, K Gasperich, PF Loos, A Scemama Advances in Quantum Chemistry 83, 65-81, 2021 | 8 | 2021 |
Spin adaptation with determinant-based selected configuration interaction T Applencourt, K Gasperich, A Scemama arXiv preprint arXiv:1812.06902, 2018 | 8 | 2018 |
Erratum: Screened Coulomb interaction calculations: cRPA implementation and applications to dynamical screening and self-consistency in uranium dioxide and cerium [Phys. Rev. B … B Amadon, T Applencourt, F Bruneval Physical Review B 96 (19), 199907, 2017 | 7 | 2017 |
Quantum package v1. 0, 2016 A Scemama, T Applencourt, Y Garniron, E Giner, G David, M Caffarel Academic Search There is no corresponding record for this reference, 0 | 7 | |
Roofline-based performance efficiency of hpc benchmarks and applications on current generation of processor architectures J Kwack, T Applencourt, C Bertoni, Y Ghadar, H Zheng, C Knight, ... 2019 Cray User Group Meeting 5, 2019 | 6 | 2019 |
Position paper: Extending codelet model for dataflow software pipelining using software-hardware co-design S Raskar, T Applencourt, K Kumaran, G Gao 2019 IEEE 43rd Annual Computer Software and Applications Conference (COMPSAC …, 2019 | 5 | 2019 |
QMC using very large configuration interaction-type expansions A Scemama, E Giner, T Applencourt, M Caffarel Pacifichem, Advances in Quantum Monte Carlo, 2015 | 4 | 2015 |
Standardizing complex numbers in SYCL T Applencourt, B Videau, J Le Quellec, A Dufek, K Harms, N Liber, B Allen, ... Proceedings of the 2023 International Workshop on OpenCL, 1-6, 2023 | 3 | 2023 |