Thermodynamic Extension of Density-functional Theory
by Robert Balawender, Andrzej Holas
Publisher: arXiv 2012
Number of pages: 144
Description:
Density-functional theory is a rigorous approach for describing the ground state of any electronic system. Topics: Basic Massieu function, its Legendre and Massieu-Planck transforms for equilibrium state in terms of density matrix; Finite-temperature ensemble spin-density functional theory; Zero-temperature limit of the ensemble spin-density functional theory.
Download or read it online for free here:
Download link 1
Download link 2
Download link 3
(multiple PDF files)
Similar books
Many-body Perturbation Theory of Moleculesby S. Wilson
This text is concerned with the application of the many-body perturbation theory to arbitrary molecular systems. The method is computationally more efficient than other schemes and has a number of theoretical properties which make it attractive.
(11860 views)
Introduction to Quantum Mechanics with Applications to Chemistryby Linus Pauling, E. Bright Wilson - McGraw-Hill Education
This undergraduate-level text applies quantum mechanics to some chemical and physical problems, covering wave functions for the hydrogen atom, perturbation theory, the Pauli exclusion principle, and the structure of simple and complex molecules.
(23873 views)
A Brief Review of Elementary Quantum Chemistryby C. David Sherrill - Georgia Institute of Technology
The ebook covers the motivation for quantum mechanics, Schrödinger equation, postulates of quantum mechanics, some analytically soluble problems, approximate methods, molecular quantum mechanics, solving the electronic eigenvalue problem.
(19361 views)
Applied Electrochemistryby Maurice de Kay Thompson - The MacMillan Company
This is an account of the most important electrochemical industries, as well as the principal applications of electrochemistry in the laboratory. The plan has been to discuss each subject from the theoretical and from the technical point of view.
(19630 views)