Classical Dynamics of the Hydrogen Atom and Muonium Trapped in Diamond Clusters: A Direct Ab-initio Dynamics Study
Author:
Publisher
The Chemical Society of Japan
Subject
General Chemistry
Link
https://www.jstage.jst.go.jp/article/bcsj/72/7/72_7_1491/_pdf
Reference15 articles.
1. Self-Consistent-Field Investigation of Location and Hyperfine Interaction of Muonium in Diamond
2. Interstitial hydrogen in diamond: A detailed Hartree-Fock analysis
3. Self-consistent field cluster investigation of muonium-related paramagnetic centres in diamond
4. A new method of calculating the spin density of trapped muonium in diamond
5. Model calculation of the spin density for trapped muonium in ionic solids
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1. Electronic states of hydrogen atom trapped in diamond lattice;Chemical Physics Letters;2011-09
2. DFT and direct ab initio MD calculations of the gas hydrate: Hydrogen molecule trapped in water cluster (H2O)12;International Journal of Quantum Chemistry;2005
3. Ab initio and hybrid DFT study on the electronic states of fluorenone–Na complexes;Phys. Chem. Chem. Phys.;2003
4. The dynamics on migrations of Li+ ion and Li atom at 700 K around the circumference of graphite cluster model: A direct molecular dynamics study;Chemical Physics Letters;2001-05
5. Dynamics of Hydrogen and Proton Trapped in Diamond Lattice. A Direct Molecular Orbital Dynamics Approach.;JOURNAL OF CHEMICAL ENGINEERING OF JAPAN;2001
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