Concepedia

Author

Baptiste Démoulin

Centre National de la Recherche ScientifiqueORCID

Also Known As

Baptiste Demoulin, Baptiste Démoulin, Demoulin, Baptiste

18

Publications

460

Citations

11

H-Index

32

Concepts

All Affiliations

Centre National de la Recherche ScientifiqueUniversity of BolognaÉcole Normale Supérieure de LyonLaboratoire de ChimieUniversité Claude Bernard Lyon 1
BD

About

Baptiste Démoulin is an author at Centre National de la Recherche Scientifique specializing in quantum chemistry, natural sciences, and physics.

Top Concepts

#ConceptH-IndexPublicationsCitations

1

Engineering

6

6

344

2

Natural Sciences

6

6

344

3

Medicine

3

3

43

4

Applied Physics

3

3

176

5

Health Sciences

1

1

12

Baptiste Démoulin

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11

Publications

443

Citations

11

H-Index

YearCitations

Newton-X Platform: New Software Developments for Surface Hopping and Nuclear Ensembles

Mario Barbatti, Mattia Bondanza, Rachel Crespo‐Otero,

Journal of Chemical Theory and Computation

2022

116

A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods

Balázs Kozma, Attila Tajti, Baptiste Démoulin,

Journal of Chemical Theory and Computation

2020

83

A domain-based local pair natural orbital implementation of the equation of motion coupled cluster method for electron attached states

Achintya Kumar Dutta, Masaaki Saitow, Baptiste Démoulin,

The Journal of Chemical Physics

2019

80

Simulations of molecular photodynamics in long timescales

Saikat Mukherjee, Max Pinheiro, Baptiste Démoulin,

Philosophical Transactions of the Royal Society A Mathematical Physical and Engineering Sciences

2022

31

Multilayer Approach to the IP-EOM-DLPNO-CCSD Method: Theory, Implementation, and Application

Soumi Haldar, Christoph Riplinger, Baptiste Démoulin,

Journal of Chemical Theory and Computation

2019

29

Fine Tuning of Retinal Photoinduced Decay in Solution

Baptiste Démoulin, Salvatore Flavio Altavilla, Ivan Rivalta,

The Journal of Physical Chemistry Letters

2017

25

Trajectory Surface Hopping for a Polarizable Embedding QM/MM Formulation

Mattia Bondanza, Baptiste Démoulin, Filippo Lipparini,

The Journal of Physical Chemistry A

2022

23

Ultraviolet vision: photophysical properties of the unprotonated retinyl Schiff base in the Siberian hamster cone pigment

Andrea Bonvicini, Baptiste Démoulin, Salvatore Flavio Altavilla,

Theoretical Chemistry Accounts

2016

16

Intramolecular photo-induced charge transfer in visual retinal chromophore mimics: electron density-based indices at the TD-DFT and post-HF levels

Baptiste Démoulin, Mohsen M. T. El‐Tahawy, Artur Nenov,

Theoretical Chemistry Accounts

2016

15

A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled-Cluster Type Methods

Balázs Kozma, Attila Tajti, Baptiste Démoulin,

2020

13

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