1.

Record Nr.

UNINA9910311936503321

Autore

Izaac Joshua

Titolo

Computational Quantum Mechanics / / by Joshua Izaac, Jingbo Wang

Pubbl/distr/stampa

Cham : , : Springer International Publishing : , : Imprint : Springer, , 2018

ISBN

3-319-99930-3

Edizione

[1st ed. 2018.]

Descrizione fisica

1 online resource (XIII, 494 p. 1 illus.)

Collana

Undergraduate Lecture Notes in Physics, , 2192-4791

Disciplina

530.12

Soggetti

Quantum theory

Physics

Atomic structure

Molecular structure

Quantum Physics

Numerical and Computational Physics, Simulation

Atomic/Molecular Structure and Spectra

Lingua di pubblicazione

Inglese

Formato

Materiale a stampa

Livello bibliografico

Monografia

Nota di contenuto

Part I Scientific programming: an introduction for physicists: Numbers and precision -- Fortran -- Python -- Part II Numerical methods for quantum physics: Finding roots -- Differentiation and initial value problems -- Numerical integration -- The eigenvalue problem -- The Fourier transform -- PART III Solving the Schrödinger equation: One dimension -- Higher dimensions and basic techniques -- Time propagation -- Central potentials -- Multi-electron systems -- Exercises.

Sommario/riassunto

Quantum mechanics undergraduate courses mostly focus on systems with known analytical solutions; the finite well, simple Harmonic, and spherical potentials. However, most problems in quantum mechanics cannot be solved analytically. This textbook introduces the numerical techniques required to tackle problems in quantum mechanics, providing numerous examples en route. No programming knowledge is required – an introduction to both Fortran and Python is included, with code examples throughout. With a hands-on approach, numerical techniques covered in this book include differentiation and integration,



ordinary and differential equations, linear algebra, and the Fourier transform. By completion of this book, the reader will be armed to solve the Schrödinger equation for arbitrarily complex potentials, and for single and multi-electron systems.