Spectroscopy of confined atomic systems: effect of plasma
The effect of spatial and other external confinements on the ground and excited state energy
levels of many electron atoms, ions and exotic systems is discussed. Special emphasis is …
levels of many electron atoms, ions and exotic systems is discussed. Special emphasis is …
Computational high‐pressure chemistry: Ab initio simulations of atoms, molecules, and extended materials in the gigapascal regime
F Zeller, CM Hsieh, W Dononelli… - Wiley Interdisciplinary …, 2024 - Wiley Online Library
The field of liquid‐phase and solid‐state high‐pressure chemistry has exploded since the
advent of the diamond anvil cell, an experimental technique that allows the application of …
advent of the diamond anvil cell, an experimental technique that allows the application of …
The hydrogen atom within spherical boxes with penetrable walls
E Ley‐Koo, S Rubinstein - The Journal of Chemical Physics, 1979 - pubs.aip.org
The hydrogen atom within a spherical box with impenetrable walls has recently been
investigated in connection with the hyperfine splitting1 and SCF calculations. 2 Both of these …
investigated in connection with the hyperfine splitting1 and SCF calculations. 2 Both of these …
Characteristic features of Shannon information entropy of confined atoms
KD Sen - The Journal of chemical physics, 2005 - pubs.aip.org
The Shannon information entropy of 1-normalized electron density in position and
momentum space S r and S p, and the sum ST, respectively, are reported for the ground …
momentum space S r and S p, and the sum ST, respectively, are reported for the ground …
Energy levels and structural properties of compressed hydrogen atom under Debye screening
B Saha, PK Mukherjee, GHF Diercksen - Astronomy & Astrophysics, 2002 - aanda.org
Time dependent variation perturbation calculations have been performed for estimating the
transition energies, oscillator strengths and transition probability values for a few dipole …
transition energies, oscillator strengths and transition probability values for a few dipole …
Highly accurate solutions for the confined hydrogen atom
N Aquino, G Campoy… - International Journal of …, 2007 - Wiley Online Library
The model of the confined hydrogen atom (CHA) was developed by Michels et al.[1] in the
mid-1930s to study matter subject to extreme pressure. However, since the eigenvalues …
mid-1930s to study matter subject to extreme pressure. However, since the eigenvalues …
Properties of atoms in molecules: atoms under pressure
RFW Bader, MA Austen - The Journal of chemical physics, 1997 - pubs.aip.org
The in situ pressure acting on the surface of an open system at the atomic level is defined
and determined by the virial theorem for a proper open system, one whose spatial boundary …
and determined by the virial theorem for a proper open system, one whose spatial boundary …
Electron‐density delocalization in many‐electron atoms confined by penetrable walls: AH artree–F ock study
M Rodriguez‐Bautista, R Vargas… - … Journal of Quantum …, 2018 - Wiley Online Library
The electronic structure of several many‐electron atoms, confined within a penetrable
spherical box, was studied using the Hartree–Fock (HF) method, coupling the Roothaan's …
spherical box, was studied using the Hartree–Fock (HF) method, coupling the Roothaan's …
The energy levels and the corresponding normalized wave functions for a model of a compressed atom
PO Fröman, S Yngve, N Fröman - Journal of mathematical physics, 1987 - pubs.aip.org
In the model of a compressed atom (or ion) considered in the present paper the boundary
condition associated with the corresponding uncompressed atom, ie, the condition that the …
condition associated with the corresponding uncompressed atom, ie, the condition that the …
[HTML][HTML] Shannon entropy: A study of confined hydrogenic-like atoms
WS Nascimento, FV Prudente - Chemical Physics Letters, 2018 - Elsevier
The Shannon entropy in the atomic, molecular and chemical physics context is presented by
using as test cases the hydrogenic-like atoms H c, He c+ and Li c 2+ confined by an …
using as test cases the hydrogenic-like atoms H c, He c+ and Li c 2+ confined by an …