Globally accurate ab initio based potential energy surface of H 2 O + ( X 4 A″)
Author:
Publisher
IOP Publishing
Subject
General Physics and Astronomy
Link
https://iopscience.iop.org/article/10.1088/1674-1056/24/6/063101/pdf
Reference47 articles.
1. State-Selected and State-to-State Ion−Molecule Reaction Dynamics
2. A comparison between experimental and theoretical excitation functions for the O++H2 (4A‘) system using trajectory calculations over a wide energy range
3. Ab initio analytical potential energy surface and quasiclassical trajectory study of the O+(4S)+H2(X 1Σg+)→OH+(X 3Σ−)+H(2S) reaction and isotopic variants
4. Potential energy surfaces and quasiclassical trajectory study of the O + H2+→ OH++ H, OH + H+proton and hydrogen atom transfer reactions and isotopic variants (D2+, HD+)
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1. An accurate many-body expansion potential energy surface for HO2 (X 2A″) by extrapolation to the complete basis set limit and quantum dynamics of the related reaction O(3P) + OH(2Π);Journal of Physics B: Atomic, Molecular and Optical Physics;2023-06-12
2. Dynamics of the proton transfer reaction O + H2+(v = 0, j = 0) → OH+ + H on the ground 12A″ potential energy surface;Molecular Physics;2022-09-15
3. Dynamics of C<sup>+</sup> + H<sub>2</sub> reaction based on a new potential energy surface;Acta Physica Sinica;2022
4. A new global analytical ab initio potential energy surface for the dynamics of the C+(2P) + SH(X2Π) reaction;Physical Chemistry Chemical Physics;2022
5. The global potential energy surface of PH2+(21A′) extrapolated to the complete basis set limit;Journal of Physics B: Atomic, Molecular and Optical Physics;2021-04-07
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