This paper is concerned with the Schrödinger equation for atoms and ions with $N=1$ to 10 electrons. In the asymptotic limit of large nuclear charge $Z$, we determine explicitly the low-lying energy levels and eigenstates. The asymptotic energies and wavefunctions are in good quantitative agreement with experimental data for positive ions, and in excellent qualitative agreement even for neutral atoms ($Z=N$). In particular, the predicted ground state spin and angular momentum quantum numbers ($^1S$ for He, Be, Ne, $^2S$ for H and Li, $^4S$ for N, $^2P$ for B and F, and $^3P$ for C and O) agree with experiment in every case. The asymptotic Schrödinger ground states agree, up to small corrections, with the semiempirical hydrogen orbital confi...
This thesis addresses, from a computational perspective, several open questions in relativistic atom...
Andrae D. Finite nuclear charge density distributions in electronic structure calculations for atoms...
In this work we report progress in the development and implementation of quantum-mechanical methods ...
Analytic approximations to nonrelativistic atomic ground state energies are obtained from the first ...
It was proved by Benguria and Lieb that for an atom where the ‘electrons’ do not satisfy the exclusi...
The analysis of calculating the total and single electron energies of a sequence of highly charged L...
Andrae D, Reiher M, Hinze J. A comparative study of finite nucleus models far low-lying states of fe...
We review results on the asymptotic behavior of the groundstate energy and the reduced one-particle ...
Exact density functionals for the exchange and correlation energies are approximated in practical ca...
Configuration-interaction (CI) models are approximations to the electronic Schrodinger equation whic...
For highly charged ions with 3 to 10 electrons, we derive explicit, closed-form quantum states which...
AbstractIn this paper, we prove that the energy of an atom with nuclear charge Z is greater than − C...
In the introductory section, we compare the total, kinetic, nuclear-electron, Coulomb, exchange, and...
Approximations are inevitable in solving realistic physics problems, and reliability of calculations...
The electrostatic potential at the nucleus is here calculated using the quantum Monte Carlo method. ...
This thesis addresses, from a computational perspective, several open questions in relativistic atom...
Andrae D. Finite nuclear charge density distributions in electronic structure calculations for atoms...
In this work we report progress in the development and implementation of quantum-mechanical methods ...
Analytic approximations to nonrelativistic atomic ground state energies are obtained from the first ...
It was proved by Benguria and Lieb that for an atom where the ‘electrons’ do not satisfy the exclusi...
The analysis of calculating the total and single electron energies of a sequence of highly charged L...
Andrae D, Reiher M, Hinze J. A comparative study of finite nucleus models far low-lying states of fe...
We review results on the asymptotic behavior of the groundstate energy and the reduced one-particle ...
Exact density functionals for the exchange and correlation energies are approximated in practical ca...
Configuration-interaction (CI) models are approximations to the electronic Schrodinger equation whic...
For highly charged ions with 3 to 10 electrons, we derive explicit, closed-form quantum states which...
AbstractIn this paper, we prove that the energy of an atom with nuclear charge Z is greater than − C...
In the introductory section, we compare the total, kinetic, nuclear-electron, Coulomb, exchange, and...
Approximations are inevitable in solving realistic physics problems, and reliability of calculations...
The electrostatic potential at the nucleus is here calculated using the quantum Monte Carlo method. ...
This thesis addresses, from a computational perspective, several open questions in relativistic atom...
Andrae D. Finite nuclear charge density distributions in electronic structure calculations for atoms...
In this work we report progress in the development and implementation of quantum-mechanical methods ...