The Electronic Structure of CaCl: Calculation by R Matrix and Generalized Quantum Defect Theory

Raouafi, Sondes; Jeung, Gwang‐Hi; Jungen, Ch.

doi:10.1006/jmsp.1999.7884

Cited by 24 publications

(20 citation statements)

References 20 publications

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“…If CaCl + adsorbs above the disiloxane cavity, the CaCl + radius of 2.35 Å (Raouafi et al, 1999) would result in a minimum height of 2.54 Å , which is close to the experimental value (2.46(7) Å ). No experimental data exist for the radius of BaCl + to our knowledge.…”

Section: On the Possibility Of Co-sorption Of Chloride With Divalent supporting

confidence: 71%

Cation sorption on the muscovite (001) surface in chloride solutions using high-resolution X-ray reflectivity

Schlegel

Nagy

Fenter

et al. 2006

Geochimica et Cosmochimica Acta

178

368

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Section: On the Possibility Of Co-sorption Of Chloride With Divalent supporting

confidence: 71%

Cation sorption on the muscovite (001) surface in chloride solutions using high-resolution X-ray reflectivity

Schlegel

Nagy

Fenter

et al. 2006

Geochimica et Cosmochimica Acta

178

368

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“…The experimental data are taken from [66] [the value of a e is computed by means of (5.2)-(5.4); in particular, D 0 0 ðCaCl þ Þ ¼ 3:878 eV follows from (5.4)]. The ab initio data given in [67] agree well with [66].…”

Section: The Cacl Moleculementioning

confidence: 68%

Anions in laser-induced plasmas

Shabanov

Gornushkin

2016

Appl. Phys. A

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The equation of state for plasmas containing negative atomic and molecular ions (anions) is modeled. The model is based on the assumption that all ionization processes and chemical reactions are at local thermal equilibrium and the Coulomb interaction in the plasma is described by the Debye-Hückel theory. In particular, the equation of state is obtained for plasmas containing the elements Ca, Cl, C, Si, N, and Ar. The equilibrium reaction constants are calculated using the latest experimental and ab initio data of spectroscopic constants for the molecules CaCl 2 , CaCl, Cl 2 , N 2 , C 2 , Si 2 , CN, SiN, SiC, and their positive and negative ions. The model is applied to laserinduced plasmas (LIPs) by including the equation of state into a fluid dynamic numerical model based on the NavierStokes equations describing an expansion of LIP plumes into an ambient gas as a reactive viscous flow with radiative losses. In particular, the formation of anions Cl -, C -, Si -, Cl À 2 , Si À 2 , C À 2 , CN -, SiC -, and SiN -in LIPs is investigated in detail.

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“…In works [11,[26][27][28][29][30][31][32] the calculation was performed in the frame of BO approximation, effect of the core rotation was not taken into account there. The core rotation was considered in the works [12,33,34], but on the other hand the effect of long-range core dipole potential in IBO region was not consistently accounted for.…”

Section: Introductionmentioning

confidence: 99%

Radiative transitions between Rydberg states of polar diatomic molecule. Part I: Linearly polarized light

Elfimov

Dorofeev

Zon

2015

Journal of Molecular Spectroscopy

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The Electronic Structure of CaCl: Calculation by R Matrix and Generalized Quantum Defect Theory

Cited by 24 publications

References 20 publications

Cation sorption on the muscovite (001) surface in chloride solutions using high-resolution X-ray reflectivity

Cation sorption on the muscovite (001) surface in chloride solutions using high-resolution X-ray reflectivity

Anions in laser-induced plasmas

Radiative transitions between Rydberg states of polar diatomic molecule. Part I: Linearly polarized light

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