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What is High-Accuracy Compton Profile of H2 about?
The document presents a high-accuracy Compton profile of molecular hydrogen derived from an explicitly correlated Gaussian wave function, achieving a total energy of -1.17442 a.u. This profile confirms recent high-energy electron-impact spectroscopy measurements while showing discrepancies with earlier x-ray Compton-scattering data. The study aims to provide a reliable radial momentum distribution for H2 to enhance the understanding of electron density in molecular systems.
- Author
- Suman Sadhukhan
- Language
- EN