Is HPC a minimum on the HCP potential surface? A failure of the Møller-Plesset perturbation theory
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference26 articles.
1. HCP, A UNIQUE PHOSPHORUS COMPOUND
2. Frequency optimized potential energy functions for the ground-state surfaces of HCN and HCP
3. Analytical potential for HCP from spectroscopic data
4. Experimental and ab initio determination of the bending potential of HCP
5. Ab initio study of structures and relative stabilities of RCP (R = H, F) and their energetically higher-lying isomers RPC
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2. FCl:PCX Complexes: Old and New Types of Halogen Bonds;The Journal of Physical Chemistry A;2012-02-29
3. Theoretical investigation on the radical-neutral reaction mechanism of CP with CH2CO and the structural nature of several low-lying intermediates;Journal of Molecular Structure: THEOCHEM;2008-07
4. Thermochemical considerations and bond enthalpy ratios involving triatomic 16-valence electron neutrals and ions and some isoelectronically related pentaatomics;International Journal of Mass Spectrometry;2007-11
5. Combined DFT, QCISD(T), and G2 mechanism investigation for the reactions of carbon monophosphide CP with unsaturated hydrocarbons allene CH2CCH2 and methylacetylene CH3CCH;Journal of Computational Chemistry;2007
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