Program of the Workshop on "Advances in electronic structure theory" (draft)
Advances in electronic structure theory
Celebrating the contributions of Andreas Savin
WORKING VERSION
Program
Monday 27 April | Tuesday 28 April | Wednesday 29 April | |
---|---|---|---|
8:30-9:00 Arrivals | |||
Chair: Gori-Giorgi
9:00-9:30 Ayers 9:30-10:00 Chan 10:00-10:30 Scuseria |
Chair: Angyan
9:00-9:30 Burke 9:30-10:00 Yang 10:00-10:30 Pernal |
Chair: Dovesi
9:00-9:30 Umrigar 9:30-10:00 Alavi 10:00-10:30 Caffarel | |
10:30-11:00 Coffee break |
10:30-11:00 Coffee break |
10:30-11:00 Coffee break | |
Chair: Reinhardt
11:00-11:30 Stoll 11:30-12:00 Saue |
Chair: Silvi
11:00-11:30 Adamo 11:30-12:00 Memorial Ziegler |
Chair: Toulouse
11:00-11:30 Filippi 11:30-12:00 Gill | |
12:00-14:00 Lunch at "L'Ardoise" Tower 25 | 12:00-14:00 Lunch at "L'Ardoise" Tower 25 | 12:00-14:00 Lunch at "L'Ardoise" Tower 25 | |
Chair: Hirao
14:00-14:30 Jensen 14:30-15:00 Luppi 15:00-15:30 Fromager |
Chair: Baerends
14:00-14:30 Gross 14:30-15:00 van Leeuwen 15:00-15:30 Casida |
Chair: Piquemal
14:00-14:30 Maday 14:30-15:00 Flad 15:00-15:30 Lewin | |
15:30-16:00 Coffee break | 15:30-16:00 Coffee break | 15:30-16:00 Coffee break | |
Chair: Alikhani
16:00-16:30 Grabowski 16:30-17:00 Teale 17:00-17:30 Wesolowski |
Chair: Reining
16:00-16:30 Maitra 16:30-17:00 Ullrich 17:00-17:30 Gatti |
Chair: Parisel
16:00-16:30 Helgaker 16:30-17:00 Mussard 17:00-17:30 Talk | |
19:30 Dinner? | 19:30 Dinner? |
Talks
- Carlo Adamo,
- Ali Alavi, Calculation of pure expectation values and properties from FCIQMC
- Paul Ayers, A Mean-Field Description of Strong Correlation Using Antisymmetric Products of Interacting Geminals
- Kieron Burke, Systematic approach to density functional approximations
- Michel Caffarel, Fixed-Node Diffusion Monte Carlo with CI-type trial wavefunctions
- Garnet Chan, dynamical correlation in multireference problems
- Emmanuel Fromager, State-averaged multi-determinant density-functional theory based on ensembles and range separation
- Claudia Filippi, Quantum Monte Carlo for excited-state calculations in complex environments
- Heinz Jurgen Flad,
- Matteo Gatti, Dynamical screening: plasmons, excitons and photoemission satellites
- Peter Gill, Using Quantum Monte Carlo and wave function methods to improve density functional theory
- Irek Grabowski, Orbital-dependent second-order scaled-opposite-spin correlation functional in the optimized effective potential method
- Hardy Gross,
- Trygve Helgaker, DFT in magnetic fields
- Hans Jørgen Jensen, Status and perspectives for multiconfiguration short-range density functional theory
- Mathieu Lewin, On the Lieb-Oxford inequality: best constant, gradient correction and the homogeneous electron gas
- Eleonora Luppi, Basis convergence in range-separated density-functional theory and in time-propagation methods
- Yvon Maday,
- Neepa Maitra, Dynamics of Charge-Transfer in Time-Dependent Density Functional Theory
- Bastien Mussard, RPA
- Kasia Pernal, A computationally efficient geminal-based method for accurate description of chemical systems
- Trond Saue, Electron correlation in a relativistic perspective
- Gustavo Scuseria, A quantum chemistry view of the strong correlation problem
- Hermann Stoll, Filling the gap between pseudopotential and all-electron schemes
- Andy Teale, Towards simple density-functional approximations from accurate ab initio theory
- Carsten Ullrich, Towards nonempirical hybrid functionals for excitonic properties in solids
- Cyrus Umrigar, Ground-state quantum Monte Carlo methods and the sign problem
- Robert van Leeuwen, The density to potential mapping in time-dependent density-functional theory
- Tomasz Wesolowski, The issue of orthogonality in Frozen-Density Embedding Theory
- Weitao Yang,
Constraints
- Lucia Reining can chair only the first or second day
- Kimihiko Hirao can chair only the first day
- Neepa Maitra cannot talk after 2pm on the last day
- Roberto Dovesi cannot chair after 2pm on the last day
- Tomasz A. Wesolowski cannot talk on the last day
- Kasia Pernal cannot talk on the first morning or on the last afternoon