High partial waves contribution in calculations of the polyvalent atoms

Fuente: arXiv
Guardado en:
Detalles Bibliográficos
Autor principal: Kozlov, M. G.
Formato: Preprint
Publicado: 2026
Materias:
Acceso en línea:
Etiquetas: Agregar Etiqueta
Sin Etiquetas, Sea el primero en etiquetar este registro!
_version_ 1866914422347268096
author Kozlov, M. G.
author_facet Kozlov, M. G.
contents High accuracy calculations of atomic properties require using long basis sets. In particular, it is necessary to include large number of partial waves and estimate truncation corrections. The convergence in partial waves is known to be rather slow, so calculations become very costly. We use valence perturbation theory [PRA \textbf{105}, 052805 (2022)] to calculate contribution of the high partial waves and estimate truncation corrections. These estimates may be useful to make assessment of theoretical error in atomic calculations more reliable.
format Preprint
id arxiv_https___arxiv_org_abs_2603_11985
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle High partial waves contribution in calculations of the polyvalent atoms
Kozlov, M. G.
Atomic Physics
High accuracy calculations of atomic properties require using long basis sets. In particular, it is necessary to include large number of partial waves and estimate truncation corrections. The convergence in partial waves is known to be rather slow, so calculations become very costly. We use valence perturbation theory [PRA \textbf{105}, 052805 (2022)] to calculate contribution of the high partial waves and estimate truncation corrections. These estimates may be useful to make assessment of theoretical error in atomic calculations more reliable.
title High partial waves contribution in calculations of the polyvalent atoms
topic Atomic Physics
url https://arxiv.org/abs/2603.11985