Multi-reference approach to the calculation of photoelectron spectra including spin-orbit coupling.

Erratum: "Multi-reference approach to the calculation of photoelectron spectra including spin-orbit coupling" [J. Chem. Phys. 143, 074104 (2015)].

Deconvoluted Si 2p Photoelectron Spectra of Ultra thin SiO2 film with FitXPS method

The main impetus for our research is provided by the growing interest worldwide in ultra thin silicon dioxide on silicon based nano devices. The obvious need for better knowledge in the ultra thin gate silicon dioxides, is motivated both by interests in fundamental research and phenomenology as well as by interests in possible applications, which can be found with better fitting of experimental...

Spin-Orbit Coupling and Potential Energy Functions of Ar2(+) and Kr2(+) by High-Resolution Photoelectron Spectroscopy and ab Initio Quantum Chemistry.

The dependence of the spin-orbit-coupling constant of the six low-lying electronic states of Ar2(+) and Kr2(+) on the internuclear distance R has been calculated ab initio. The spin-orbit-coupling constant varies by about 10% over the range of internuclear distances relevant for the interpretation of the high-resolution photoelectron spectra of Ar2 and Kr2 and can be accurately represented by a...

Photoelectron spectroscopic study of the E⊗e Jahn-Teller effect in the presence of a tunable spin-orbit interaction. I. Photoionization dynamics of methyl iodide and rotational fine structure of CH3I+ and CD3I+.

The high-resolution single-photon pulsed-field-ionization zero-kinetic-energy photoelectron spectra of the X̃(+) (2)E(3/2)←X̃(1)A(1) transition of CH(3)I and CD(3)I have been recorded. The spectral resolution of better than 0.15 cm(-1) enabled the observation of the rotational structure. CH(3)I(+) and CD(3)I(+) are subject to a weak E⊗e Jahn-Teller effect and strong spin-orbit coupling. The treat...

اثر برهم‌کنش اسپین‌ مدار یکنواخت و میدان مغناطیسی یکنواخت بر خواص توپولوژیکی یک نانو سیم یک بعدی کوانتومی

We theoretically demonstrate the interplay of uniform spin-orbit coupling and uniform Zeeman magnetic field on the topological properties of one-dimensional double well nano wire which is known as Su-Schrieffer-Heeger (SSH) model. The system in the absence of Zeeman magnetic field and presence of uniform spin-orbit coupling exhibits topologically trivial/non–trivial insulator depending on the h...