Différences entre les versions de « Program of the Workshop on "Advances in electronic structure theory" (draft) »
Aller à la navigation
Aller à la recherche
(→Talks) |
|||
(11 versions intermédiaires par le même utilisateur non affichées) | |||
Ligne 1 : | Ligne 1 : | ||
− | Celebrating the contributions of Andreas Savin | + | |
+ | <big><big><big>Celebrating the contributions of Andreas Savin | ||
+ | </big></big></big> | ||
'''<font color="red">WORKING VERSION</font>''' | '''<font color="red">WORKING VERSION</font>''' | ||
Ligne 49 : | Ligne 51 : | ||
'''11:30-12:00 Memorial Ziegler''' | '''11:30-12:00 Memorial Ziegler''' | ||
− | !''Chair: | + | !''Chair: Alikhani'' |
'''11:00-11:30 Filippi''' | '''11:00-11:30 Filippi''' | ||
Ligne 63 : | Ligne 65 : | ||
'''14:00-14:30 Jensen''' | '''14:00-14:30 Jensen''' | ||
− | '''14:30-15:00 | + | '''14:30-15:00 Fromager''' |
− | '''15:00-15:30 | + | '''15:00-15:30 Luppi''' |
! ''Chair: Baerends'' | ! ''Chair: Baerends'' | ||
Ligne 77 : | Ligne 79 : | ||
'''14:00-14:30 Maday''' | '''14:00-14:30 Maday''' | ||
− | '''14:30-15:00 | + | '''14:30-15:00 Rebolini''' |
'''15:00-15:30 Lewin''' | '''15:00-15:30 Lewin''' | ||
Ligne 87 : | Ligne 89 : | ||
! | ! | ||
|-align="left" | |-align="left" | ||
− | ! ''Chair: | + | ! ''Chair: Toulouse'' |
'''16:00-16:30 Grabowski''' | '''16:00-16:30 Grabowski''' | ||
Ligne 102 : | Ligne 104 : | ||
! ''Chair: Parisel'' | ! ''Chair: Parisel'' | ||
− | '''16:00-16:30 | + | '''16:00-16:30 Mussard''' |
− | '''16:30-17:00 | + | '''16:30-17:00 Helgaker''' |
− | |||
|-align="left" | |-align="left" | ||
− | ! <font color="green"> | + | ! <font color="green"></font> |
− | ! <font color="green"> | + | ! <font color="green"></font> |
! <font color="green"></font> | ! <font color="green"></font> | ||
! | ! | ||
|} | |} | ||
− | |||
== Talks == | == Talks == | ||
Ligne 122 : | Ligne 122 : | ||
* Kieron Burke, ''Systematic approach to density functional approximations'' | * Kieron Burke, ''Systematic approach to density functional approximations'' | ||
* Michel Caffarel, ''Fixed-Node Diffusion Monte Carlo with CI-type trial wavefunctions'' | * Michel Caffarel, ''Fixed-Node Diffusion Monte Carlo with CI-type trial wavefunctions'' | ||
+ | * Mark Casisa, ''Challenge of time-dependent density-functional theory for photochemistry'' | ||
* Garnet Chan, ''dynamical correlation in multireference problems'' | * Garnet Chan, ''dynamical correlation in multireference problems'' | ||
* Emmanuel Fromager, ''State-averaged multi-determinant density-functional theory based on ensembles and range separation'' | * 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'' | * Claudia Filippi, ''Quantum Monte Carlo for excited-state calculations in complex environments'' | ||
− | |||
* Matteo Gatti, ''Dynamical screening: plasmons, excitons and photoemission satellites'' | * Matteo Gatti, ''Dynamical screening: plasmons, excitons and photoemission satellites'' | ||
* Peter Gill, ''Using Quantum Monte Carlo and wave function methods to improve density functional theory'' | * Peter Gill, ''Using Quantum Monte Carlo and wave function methods to improve density functional theory'' | ||
Ligne 134 : | Ligne 134 : | ||
* Mathieu Lewin, ''On the Lieb-Oxford inequality: best constant, gradient correction and the homogeneous electron gas'' | * 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'' | * Eleonora Luppi, ''Basis convergence in range-separated density-functional theory and in time-propagation methods'' | ||
− | * Yvon Maday, '' '' | + | * Yvon Maday, ''Some elements of analysis for Andreas' systematic way to correct density functional approximation'' |
* Neepa Maitra, ''Dynamics of Charge-Transfer in Time-Dependent Density Functional Theory'' | * Neepa Maitra, ''Dynamics of Charge-Transfer in Time-Dependent Density Functional Theory'' | ||
* Bastien Mussard, ''RPA'' | * Bastien Mussard, ''RPA'' | ||
* Kasia Pernal, ''A computationally efficient geminal-based method for accurate description of chemical systems'' | * Kasia Pernal, ''A computationally efficient geminal-based method for accurate description of chemical systems'' | ||
+ | * Elisa Rebolini, ''Calculating excitation energies by extrapolation along adiabatic connections'' | ||
* Trond Saue, ''Electron correlation in a relativistic perspective'' | * Trond Saue, ''Electron correlation in a relativistic perspective'' | ||
* Gustavo Scuseria, ''A quantum chemistry view of the strong correlation problem'' | * Gustavo Scuseria, ''A quantum chemistry view of the strong correlation problem'' | ||
Ligne 146 : | Ligne 147 : | ||
* Robert van Leeuwen, ''The density to potential mapping in time-dependent density-functional theory'' | * 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'' | * Tomasz Wesolowski, ''The issue of orthogonality in Frozen-Density Embedding Theory'' | ||
− | * Weitao Yang, '' '' | + | * Weitao Yang, ''Fractional Perspectives of DFT and Local Scaling Corrections'' |
== Constraints == | == Constraints == |
Dernière version du 11 avril 2015 à 08:18
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: Alikhani
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 Fromager 15:00-15:30 Luppi |
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 Rebolini 15:00-15:30 Lewin | |
15:30-16:00 Coffee break | 15:30-16:00 Coffee break | 15:30-16:00 Coffee break | |
Chair: Toulouse
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 Mussard 16:30-17:00 Helgaker
| |
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
- Mark Casisa, Challenge of time-dependent density-functional theory for photochemistry
- 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
- 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, Some elements of analysis for Andreas' systematic way to correct density functional approximation
- 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
- Elisa Rebolini, Calculating excitation energies by extrapolation along adiabatic connections
- 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, Fractional Perspectives of DFT and Local Scaling Corrections
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