Theory and application of explicitly correlated Gaussians

J Mitroy, S Bubin, W Horiuchi, Y Suzuki… - Reviews of modern …, 2013 - APS
The variational method complemented with the use of explicitly correlated Gaussian basis
functions is one of the most powerful approaches currently used for calculating the …

Born–Oppenheimer and non-Born–Oppenheimer, atomic and molecular calculations with explicitly correlated Gaussians

S Bubin, M Pavanello, WC Tung, KL Sharkey… - Chemical …, 2013 - ACS Publications
Since the early work of Hylleraas on the helium atom, 1 it has been common knowledge that,
to accurately account for the interaction between the electrons in an atom or a molecule …

Fine structure of the energy levels of singly ionized carbon (C ii)

M Stanke, A Kędziorski, S Nasiri, L Adamowicz… - Physical Review A, 2023 - APS
Benchmark variational calculations of the lowest eight Rydberg 2 P o states of the singly
ionized carbon atom (stable isotopes C+ 12, C+ 13, and C+ 14, as well as the infinite …

Isotope shifts in beryllium-, boron-, carbon-, and nitrogen-like ions from relativistic configuration interaction calculations

C Nazé, S Verdebout, P Rynkun, G Gaigalas… - Atomic Data and …, 2014 - Elsevier
Energy levels, normal and specific mass shift parameters as well as electronic densities at
the nucleus are reported for numerous states along the beryllium, boron, carbon, and …

Critically evaluated spectral data for singly ionized carbon (C ii)

A Kramida, K Haris - The Astrophysical Journal Supplement …, 2022 - iopscience.iop.org
All available experimental data on the spectrum of singly ionized carbon have been critically
analyzed. Measurement uncertainties of all published studies have been reassessed. The …

Rydberg spectrum of the boron atom

I Hornyák, S Nasiri, S Bubin, L Adamowicz - Physical Review A, 2021 - APS
Benchmark variational calculations of the lowest ten Rydberg S 2 states of two stable
isotopes of the boron atom (B 10 and B 11) are reported. The nonrelativistic wave functions …

Absolute frequency measurement of the transitions in neutral

KJ Ahrendsen, C Maruko, KR Albert-Aranovich… - Physical Review A, 2023 - APS
We report absolute frequency measurements on the three excited-state transitions
connecting the 2 p 2 (3 P) 3 s 2 P 1/2, 3/2 and 2 p 2 (3 P) 3 p 2 D 3/2, 5/2∘ states in neutral N …

Low-lying states of the singly charged carbon ion

I Hornyák, L Adamowicz, S Bubin - Physical Review A, 2020 - APS
In this work, we report benchmark variational calculations of the five lowest doublet S-states
of the C+ ion. The wave functions of this five-electron system are expanded in terms of 16 …

[HTML][HTML] Benchmark calculations of the energy spectra and oscillator strengths of the beryllium atom

S Nasiri, L Adamowicz, S Bubin - Journal of Physical and Chemical …, 2021 - pubs.aip.org
In this work, we present a series of benchmark variational calculations for the ground and 19
lowest bound excited singlet S and P states of the beryllium atom. The nonrelativistic wave …

Compact wave functions for the beryllium isoelectronic series, Li− to Ne6+: A standard Hylleraas approach

FW King, D Quicker, J Langer - The Journal of chemical physics, 2011 - pubs.aip.org
Variational calculations have been carried out for the ground states of several members of
the beryllium isoelectronic series using a standard Hylleraas approach involving Slater-type …