Éric Cancès - Publications, H-index & Citations

Éric Cancès

centre national de la recherche scientifique (cnrs)

36H指数

158论文数

7.0K被引数

收录论文 34

发表时间

Multi-center decomposition of molecular densities: A numerical perspective

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2025-02-18

PREAI

Cheng, Yingxing; Cances, Eric; Ehrlacher, Virginie; Misquitta, Alston J.; Stamm, Benjamin

Photoionization and core resonances from range-separated time-dependent density-functional theory for open-shell states: Example of the lithium atom

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-12-28

OAAI

Toulouse, Julien; Schwinn, Karno; Zapata, Felipe; Levitt, Antoine; Cances, Eric; Luppi, Eleonora

PRACTICAL ERROR BOUNDS FOR PROPERTIES IN PLANE-WAVE ELECTRONIC STRUCTURE CALCULATIONS

SIAM JOURNAL ON SCIENTIFIC COMPUTING

IF2.6

2022-10-17

OAAI

Cances, Eric; Dusson, Genevieve; Kemlin, Gaspard; Levitt, Antoine

Photoionization and core resonances from range-separated density-functional theory: General formalism and example of the beryllium atom

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-06-09

OAAI

Schwinn, Karno; Zapata, Felipe; Levitt, Antoine; Cances, Eric; Luppi, Eleonora; Toulouse, Julien

Multi-center decomposition of molecular densities: A mathematical perspective

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-04-28

OAAI

Benda, Robert; Cances, Eric; Ehrlacher, Virginie; Stamm, Benjamin

An embedded corrector problem for homogenization. Part II: Algorithms and discretization

JOURNAL OF COMPUTATIONAL PHYSICS

IF3.8

2020-04-01

OAAI

Cances, Eric; Ehrlacher, Virginie; Legoll, Frederic; Stamm, Benjamin; Xiang, Shuyang

Second-order shape derivatives along normal trajectories, governed by Hamilton-Jacobi equations

STRUCTURAL AND MULTIDISCIPLINARY OPTIMIZATION

IF4

2016-06-27

OAAI

Allaire, G.; Cances, E.; Vie, J. -L.

A new discretization for the polarizable continuum model within the domain decomposition paradigm

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2016-02-01

PREAI

Stamm, Benjamin; Cances, Eric; Lipparini, Filippo; Maday, Yvon

A perturbation-method-based post-processing for the planewave discretization of Kohn-Sham models

JOURNAL OF COMPUTATIONAL PHYSICS

IF3.8

2016-02-01

OAAI

Cances, Eric; Dusson, Genevieve; Maday, Yvon; Stamm, Benjamin; Vohralik, Martin

Scalable Evaluation of Polarization Energy and Associated Forces in Polarizable Molecular Dynamics: II. Toward Massively Parallel Computations Using Smooth Particle Mesh Ewald

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2015-05-21

OAAI

Lagardere, Louis; Lipparini, Filippo; Polack, Etienne; Stamm, Benjamin; Cances, Eric; Schnieders, Michael; Ren, Pengyu; Maday, Yvon; Piquemal, Jean-Philip

Polarizable Molecular Dynamics in a Polarizable Continuum Solvent

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2015-01-26

OAAI

Lipparini, Filippo; Lagardere, Louis; Raynaud, Christophe; Stamm, Benjamin; Cances, Eric; Mennucci, Benedetta; Schnieders, Michael; Ren, Pengyu; Maday, Yvon; Piquemal, Jean-Philip

Quantum, classical, and hybrid QM/MM calculations in solution: General implementation of the ddCOSMO linear scaling strategy

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2014-11-12

PREAI

Lipparini, Filippo; Scalmani, Giovanni; Lagardere, Louis; Stamm, Benjamin; Cances, Eric; Maday, Yvon; Piquemal, Jean-Philip; Frisch, Michael J.; Mennucci, Benedetta

Scalable Evaluation of Polarization Energy and Associated Forces in Polarizable Molecular Dynamics: I. Toward Massively Parallel Direct Space Computations

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2014-03-14

OAAI

Lipparini, Filippo; Lagardere, Louis; Stamm, Benjamin; Cances, Eric; Schnieders, Michael; Ren, Pengyu; Maday, Yvon; Piquemal, Jean-Philip

Domain decomposition for implicit solvation models

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2013-08-05

OAAI

Cances, Eric; Maday, Yvon; Stamm, Benjamin