Closed-form spin-relativistic corrections from the Dirac equation enabling a modified Schrödinger solver

We revisit the non-relativistic limit of the Dirac equation in finite scalar and vector potentials and derive a Schrödinger-like equation that retains leading spin-relativistic corrections in closed form. For general central potentials, we cast the radial equation into a quadratic eigenvalue problem (QEP) using a finite-difference discretization method and develop an open-source solver to address it. We study Coulomb, harmonic oscillator, Woods-Saxon, and Yukawa potentials. We further obtain first-order energy and wavefunction corrections for the three-dimensional isotropic harmonic oscillator and Coulomb potentials via perturbation theory. This framework provides a practical bridge between non-relativistic and fully relativistic treatments, enabling accurate quantification of relativistic effects without the computational cost of full four-component calculations.

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Publication Details

Journal
Scientific Reports
Published
2025-12-21
DOI
https://doi.org/10.1038/s41598-025-29243-4
Primary Topic
Quantum Mechanics and Non-Hermitian Physics
Type
article
Field-Weighted Citation Impact
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article

Closed-form spin-relativistic corrections from the Dirac equation enabling a modified Schrödinger solver

Scientific Reports
Quantum Mechanics and Non-Hermitian Physics
article

Closed-form spin-relativistic corrections from the Dirac equation enabling a modified Schrödinger solver

article en

Abstract

We revisit the non-relativistic limit of the Dirac equation in finite scalar and vector potentials and derive a Schrödinger-like equation that retains leading spin-relativistic corrections in closed form. For general central potentials, we cast the radial equation into a quadratic eigenvalue problem (QEP) using a finite-difference discretization method and develop an open-source solver to address it. We study Coulomb, harmonic oscillator, Woods-Saxon, and Yukawa potentials. We further obtain first-order energy and wavefunction corrections for the three-dimensional isotropic harmonic oscillator and Coulomb potentials via perturbation theory. This framework provides a practical bridge between non-relativistic and fully relativistic treatments, enabling accurate quantification of relativistic effects without the computational cost of full four-component calculations.

Scientific ReportsVol. 16(1)
Université de Bordeaux (FR), Stockholm University (SE), Academia Oamenilor de Știință din România (RO), Birla Institute of Technology and Science - Hyderabad Campus (IN), KTH Royal Institute of Technology (SE)
Openalex Percentile: Top 66%
Quantum Mechanics and Non-Hermitian Physics
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Closed-form spin-relativistic corrections from the Dirac equation enabling a modified Schrödinger solver · Scientific Reports (2025) | TGRS Research Map | TGRS