Impact of the Heitler--London hydrogen molecule paper on chemistry
Description
This year marks the fiftieth anniversary of the justly celebrated paper by Heitler and London on the quantum mechanical treatment of the hydrogen molecule. A brief survey is given of some of the more important papers built on the Heitler-London classic. In addition, the question of the physical interpretation of approximate wave functions is discussed and some of the pitfalls exemplified. Several different analyses of the bonding are reviewed, and it is concluded that the most satisfactory physical interpretation is that based on the Hellmann-Feynman theorem: the true wave function is the function which minimizes the sum of the potential and kinetic energies. This causes some excess charge in the central region so as to minimize the kinetic energy at least cost in potential energy. This excess electronic charge holds the nuclei together, much as was postulated by G. N. Lewis
Additional details
Additional titles
- Augmented title (English)
- Review, quantum mechanics
Publishing Information
- Journal Title
- Int. J. Quant. Chem., Symp.
- Journal Issue
- no.11
- Series
- Int. J. Quant. Chem., Symp.
Conference
- Title
- International symposium on atomic, molecular, and solid state theory, collision phenomenon, and computational methods.
- Dates
- 16 Jan 1977.
- Place
- Sanibel Island, Florida, USA.
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 9380598
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Resource subtype / Literary indicator
- Conference
- Descriptors DEI
- ELECTRONIC STRUCTURE; HYDROGEN; KINETIC ENERGY; POTENTIAL ENERGY; REVIEWS; WAVE FUNCTIONS
- Descriptors DEC
- DOCUMENT TYPES; ELEMENTS; ENERGY; FUNCTIONS; NONMETALS