Cargando…
Digital quantum simulation of molecular vibrations
Molecular vibrations underpin important phenomena such as spectral properties, energy transfer, and molecular bonding. However, obtaining a detailed understanding of the vibrational structure of even small molecules is computationally expensive. While several algorithms exist for efficiently solving...
Autores principales: | McArdle, Sam, Mayorov, Alexander, Shan, Xiao, Benjamin, Simon, Yuan, Xiao |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Royal Society of Chemistry
2019
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6568047/ https://www.ncbi.nlm.nih.gov/pubmed/31293758 http://dx.doi.org/10.1039/c9sc01313j |
Ejemplares similares
-
Vibrational energy redistribution in crystalline nitromethane simulated by ab initio molecular dynamics
por: Lu, Meilin, et al.
Publicado: (2021) -
Hardware efficient quantum algorithms for vibrational structure calculations
por: Ollitrault, Pauline J., et al.
Publicado: (2020) -
Toward practical quantum embedding simulation of realistic chemical systems on near-term quantum computers
por: Li, Weitang, et al.
Publicado: (2022) -
Optimizing the number of measurements for vibrational structure on quantum computers: coordinates and measurement schemes
por: Majland, Marco, et al.
Publicado: (2023) -
A two-qubit molecular architecture for electron-mediated nuclear quantum simulation
por: Atzori, Matteo, et al.
Publicado: (2018)