Theoretical study of M+ RG2: (M+= Ca, Sr, Ba and Ra; RG= He–Rn)

QR Code

Theoretical study of M+ RG2: (M+= Ca, Sr, Ba and Ra; RG= He–Rn)

Ab initio calculations were employed to investigate M+ RG2 species, where M+ = Ca, Sr, Ba and Ra and RG= He–Rn. Geometries have been optimized, and cuts through the potential energy surfaces containing each global minimum have been calculated at the MP2 level of theory, employing triple-ζ quality ba...

Full description

Bibliographic Details
Main Authors:	Andrejeva, Anna, Gardner, Adrian M., Graneek, Jack B., Breckenridge, William, Wright, Timothy G.
Format:	Article
Published:	American Chemical Society 2015
Online Access:	https://eprints.nottingham.ac.uk/30384/

Similar Items

A surprisingly simple electrostatic model explains bent vs. linear structures in M+-RG2 species (M = group 1 metal, Li–Fr; RG = rare gas, He–Rn)
by: Andrejeva, Anna, et al.
Published: (2015)

Theoretical study of Si+(2PJ)-RG complexes and transport of Si+(2PJ) in RG (RG = He – Ar)
by: Tuttle, William D., et al.
Published: (2017)

Interaction of the NO 3pπ (C 2Π) Rydberg state with RG (RG = Ne, Kr, and Xe): potential energy surfaces and spectroscopy
by: Ershova, Olga V., et al.
Published: (2015)

Cage effect in the dissociation of van der Waals complexes RgI2 (Rg=Ar, Kr, Xe): A quasiclassical trajectory study
by: Ibrahim Ali , Noorbatcha
Published: (1984)

Rootkit Guard (RG) - an architecture for rootkit resistant file-system implementation based on TPM
by: Yew, Teh Jia, et al.
Published: (2013)

In vitro study of postbiotics from Lactobacillus plantarum RG14 on rumen fermentation and microbial population
by: Wan Ibrahim, Izuddin, et al.
Published: (2018)

HM+ and HM+‑He (M = Group 2 metal): chemical or physical interactions?
by: Harris, Joe P., et al.
Published: (2014)

Experimental verification of lift enhancement of laminar flow airfoil RG15 in low Reynolds number boundary layers
by: Ariff, Omar Kassim, et al.
Published: (2015)

Supplementation of postbiotic RG14 in post-weaning dorper lambs to enhance growth performance, gut health and immunity
by: Wan Ibrahim, Wan Ahmad Izuddin
Published: (2018)

Influence of postbiotic RG14 and inulin combination on cecal microbiota, organic acid concentration, and cytokine expression in broiler chickens
by: Kareem, Karwan Yaseen, et al.
Published: (2017)

Phase evolution and microstructural development in sol-gel derived MSnO3 (M = Ca, Sr and Ba)
by: Azad, A.-M., et al.
Published: (2000)

Effect of Alkaline Earth Metal (M= Sr, Ca and Mg) Substitution on Dielectric Properties of Ba₁₋ₓMₓPbO₃ Ceramics
by: Ari Sulistyo, Rini
Published: (2002)

Identification and provenance determination of distally transported, Vredefort-derived shocked minerals in the Vaal River, South Africa using SEM and SHRIMP-RG techniques
by: Erickson, T., et al.
Published: (2013)

Synthesis and luminescence properties of glass ceramics containing MSiO3:Eu2 (M=Ca, Sr, Ba) phosphors for white LED
by: Cui, Z., et al.
Published: (2012)

The Expression Of Insulin-Like Growth Factors And Their Receptors At Preimplantation Stage In Reproductive Tissue Of Diabetic Mouse [RG580.D5 R148 2007 f rb].
by: Zakaria, Rahimah
Published: (2006)

Sr/Ca, Mg/Ca and Ba/Ca Ratios in the Otolith of Sea Bass in Peninsular Malaysia as salinity influence markers
by: Afiza Suriani Sarimin,, et al.
Published: (2014)

Phase diagrams and stoichiometries of the solid electrolytes, Bi 4V2O11: M, M = Co, Cu, Zn, Ca, Sr
by: Chnoong, Kheng Lee, et al.
Published: (1994)

Proton-Mitsubishi talks : Dr M says he was unaware
Published: (2008)

Dielectric Properties of Ceramic, CaCu3Ti4O12, Substituted with Sr or Ba
by: Che Ros, Fadhlina
Published: (2007)

Synthesis and dielectric properties of Bi₃.₃₆Mg₁.₉₂₋ₓAₓNb₂.₇₂O₁₃.₇₆ (A = Ca, Sr AND Ba) pyrochlore systems
by: Mat Dasin, Nurul Aidayu
Published: (2017)

Consistent assignment of the vibrations of symmetric and asymmetric para-disubstituted benzene molecules
by: Andrejeva, Anna, et al.
Published: (2016)

EN to RN: The transition experience pre-and post-graduation
by: Rapley, Pat, et al.
Published: (2006)

A Case Study On RN Konsult Sdn. Bhd.
by: Ahmad, Abd Razak
Published: (1998)

Analog-q bagi transformasi linear terhadap polinomial Rn
by: Murid, Ali H. M.
Published: (1991)

Inelastic collisions of CaH with He at cryogenic temperatures
by: Singh, V., et al.
Published: (2013)

Electron-phonon interaction in Gd 1-xCa xBaSrCu 3O 7-δ superconductors
by: Chong, T.V., et al.
Published: (2012)

Synthesis and characterization of lanthanum silicate oxyapatites co-doped with A (A = Ba, Sr, and Ca) and Fe for solid oxide fuel cells
by: Cao, X., et al.
Published: (2014)

Structural, magnetic and electrical properties of La-A-Mn-O (A=Ca, Sr, Ba, Na and K) in bulk and thin film
by: Ng, Siau Wei
Published: (2011)

Effect of La₀.₆₇Aₒ.₃₃MnO₃ (A= Ba, Ca, Sr) manganites on the superconducting properties of YBa₂Cu₃O₇ˍδ
by: Baharuddin Pallan, Nur Fadilah
Published: (2013)

Estimating daily net radiation flux (Rn) using remote sensing technique
by: Nurliyana, Md Asar
Published: (2009)

Effect of divalent ions (A = Ca, Ba and Sr) substitution in La-A-Mn-O manganite on structural, magnetic and electrical transport properties
by: Lim, Kean Pah, et al.
Published: (2009)

Transport coefficients of He+ ions in helium
by: Viehland, Larry A., et al.
Published: (2016)

Towards understanding pre-mRNA splicing mechanisms and the role of SR proteins
by: Sahebi, Mahbod, et al.
Published: (2016)

Industrial radiotracer application for flow rate measurement using Ba-137m radioisotope
by: Mohd Yunos, Mohd Amirul Syafiq, et al.
Published: (2017)

Thermal diffusivity measurement of Zn, Ba, V, Y and Sn doped Bi-Pb-Sr-Ca-Cu-O ceramics superconductors by photoacoustic technique
by: M. Yunus, W. M., et al.
Published: (2002)

The Effects Of Alkaline Earth Metals In Nimo-x (X = Mg, Ca, Sr, Ba) Catalysts On The Characteristics Of Carbon Nanotubes Derived From Plastics Pyrolysis
by: Lim, Xiu Xian
Published: (2024)

Magnetoresistive and magnetic properties of La0.67A0.33MnO3 (A= Ba, Ca, and Sr) prepared by co-precipitation method.
by: Ng , S. W., et al.
Published: (2009)

Resonance-enhanced multiphoton ionization spectroscopy oflaser-ablated copper atoms
by: Andrejeva, Anna, et al.
Published: (2014)

Studies of Sn Substitution on Ca and Cu Sites of Bi-Sr-Ca-Cu-O Superconducting System
by: Hashim, Azhan, et al.
Published: (2002)

Effects of (Ba₀.₆Sr₀.₄)TiO₃ ceramic and ZnO-TeO₂ glass doping ondielectric properties of CaCu₃Ti₄O₁₂ ceramics / Norezan Ibrahim
by: Ibrahim, Norezan
Published: (2014)