Iryna Knysh

Publication Activity (10 Years)

Years Active: 2023-2024
Publications (10 Years): 6

Top Topics

Molecular Dynamics

Energy Transfer

Density Functional Theory

High Resolution

Top Venues

The journal of physical chemistry letters

Physical chemistry chemical physics : PCCP

The Journal of chemical physics

The journal of physical chemistry. A

This page only lists publications with an associated author ORCID identifier.

Publications

Iryna Knysh, Filippo Lipparini, Aymeric Blondel, Ivan Duchemin, Xavier Blase, Pierre-François Loos, Denis Jacquemin
Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/ GW , and Wave Function Methods. Journal of chemical theory and computation (2024)
Iryna Knysh, Jose D J Villalobos-Castro, Ivan Duchemin, Xavier Blase, Denis Jacquemin
Excess and excited-state dipole moments of real-life dyes: a comparison between wave-function, BSE/ GW , and TD-DFT values. Physical chemistry chemical physics : PCCP (2023)
Iryna Knysh, Jose D J Villalobos-Castro, Ivan Duchemin, Xavier Blase, Denis Jacquemin
Correction to "Exploring Bethe-Salpeter Excited-State Dipoles: The Challenging Case of Increasingly Long Push-Pull Oligomers". The journal of physical chemistry letters (2023)
Jose D J Villalobos-Castro, Iryna Knysh, Denis Jacquemin, Ivan Duchemin, Xavier Blase
Lagrangian Z-vector approach to Bethe-Salpeter analytic gradients: Assessing approximations. The Journal of chemical physics 159 (2) (2023)
Alexandre Chemin, Iryna Knysh, Denis Ari, Marie Cordier, Thierry Roisnel, Boris Le Guennic, Muriel Hissler, Denis Jacquemin, Pierre-Antoine Bouit
Phospha-cyanines in Their Ideal Polymethine State: Synthesis and Structure-Property Relationships. The journal of physical chemistry. A (2023)
Iryna Knysh, Jose D J Villalobos-Castro, Ivan Duchemin, Xavier Blase, Denis Jacquemin
Exploring Bethe-Salpeter Excited-State Dipoles: The Challenging Case of Increasingly Long Push-Pull Oligomers. The journal of physical chemistry letters (2023)