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The photoelectron spectrum of water has been recorded in the vicinity of the ${\mathrm {\tilde A^+}}$ $\leftarrow$ $\tilde{\mathrm{X}}$ transition between 112 000 and 116 000 cm$^{-1}$ (13.89-14.38 eV). The high-resolution allowed the…

Chemical Physics · Physics 2017-05-03 Clément Lauzin , Bérenger Gans , Frédéric Merkt

The pulsed-field-ionization zero-kinetic-energy photoelectron spectrum of H$_2$ has been recorded in the vicinity of the dissociative-ionization threshold following three-photon excitation via selected rotational levels of the B…

Chemical Physics · Physics 2017-01-04 Maximilian Beyer , Frédéric Merkt

The cross section and rate constants for the title reaction are calculated for all the spin-orbit states of N$^+$($^3P_{J_A}$) using two statistical approaches, one purely adiabatic and the other one mixing quantum capture for the entrance…

Chemical Physics · Physics 2022-07-26 Susana Gomez-Carrasco , Daniel Felix-Gonzalez , Alfredo Aguado , Octavio Roncero

The 3d electronic structure and phase transition in pure and Cr doped V2O3 are theoretically investigated in relation to the 3d spin-orbit interaction and lattice distortion. A model consisting of the nearest-neighbor V ion pair with full…

Strongly Correlated Electrons · Physics 2016-08-31 Arata Tanaka

We present a comprehensive analysis of all currently available high-accuracy frequency measurements of rotational and rovibrational transitions in the hydrogen molecular ion HD$^+$. Our analysis utilises the theoretically calculated…

Atomic Physics · Physics 2023-05-11 Jean-Philippe Karr , Jeroen C. J. Koelemeij

The electronic structure of the ICl+ molecular ion is investigated by using high-level multireference configuration interaction (MRCI) method. To improve computational accuracy, Davidson corrections, spin-orbit coupling (SOC), and…

Atomic Physics · Physics 2025-11-25 Rui Li , Ronglong Dou , Ting Gao , Qinan Li , Chaoqun Song

The OH$^+$ ($X ^3\Sigma^-$) radical cation has been investigated by combining a 4 K 22-pole ion trap apparatus with high-resolution IR and THz radiation sources. Applying different types of action spectroscopic methods, the fundamental…

We report rovibronic spectra of the A $^3\Sigma^+$($v'=0-2$) - X $^3\Pi_\Omega(v=0)$ rovibronic transitions ($|\Omega|=0, 1$ and 2) of the CO$^{2+}$ doubly-charged molecular ion. Spectra were recorded at high resolution ($\sim 5$~cm$^{-1}$)…

Atomic Physics · Physics 2026-01-06 X. Huet , A. Aerts , N. Vaeck , M. Génévriez , X. Urbain

The delicate interplay of electronic charge, spin, and orbital degrees of freedom is in the heart of many novel phenomena across the transition metal oxide family. Here, by combining high- resolution angle resolved photoemission…

The $\mathrm{X}^+\ ^2\Sigma_u^+$ ground electronic state of the Mg$_2^+$ ion has been studied by pulsed-field-ionization zero-kinetic-energy (PFI-ZEKE) photoelectron spectroscopy. Rotationally cold Mg$_2$ molecules produced in a…

Atomic Physics · Physics 2022-03-14 Matthieu Génévriez , Maxime Holdener , Carla Kreis , Frédéric Merkt

Neutron and X-ray diffraction, magnetic susceptibility, and specific heat measurements have been used to investigate the magnetic and structural phase transitions of the spinel system Fe1+xCr2-xO4(0.0<=x<=1.0). The temperature versus Fe…

The theoretical aspects of spin-rotation coupling are presented. The approach is based on the general covariance principle. It is shown that the gyrogravitational ratio of the bare spin-1/2 and the spin-1 particles is equal unity. That is…

Atomic Physics · Physics 2009-08-03 Igor M. Pavlichenkov

The electronic properties of excitonic insulators have been examined precisely in recent years. Pictures of exciton condensation may be applied to the spin-state transition observed in perovskite cobalt oxides. We examine the crystal-field…

Strongly Correlated Electrons · Physics 2022-10-12 Koya Kitagawa , Hiroaki Matsueda

X-ray photoelectron spectra provide a wealth of information on the electronic structure. The extraction of molecular details requires adequate theoretical methods, which in case of transition metal complexes has to account for effects due…

High spin systems, like those that incorporate rare-earth $4f$ elements (REEs), are increasingly relevant in many fields. Although research in such systems is sparse, the large Hilbert spaces they occupy are promising for many applications.…

Mesoscale and Nanoscale Physics · Physics 2023-08-16 David W. Facemyer , Naveen K. Dandu , Alex Taekyung Lee , Vijay R. Singh , Anh T. Ngo , Sergio E. Ulloa

We report on the measurement and analysis of photoionisation, mass-analysed-threshold-ionisation and pulsed-field-ionisation zero-kinetic-energy photoelectron spectra of HD in the vicinity of the dissociative-ionisation thresholds H$^+$ +…

Atomic Physics · Physics 2023-01-11 Maximilian Beyer , Frédéric Merkt

In this study, X-ray spectral and pulse timing analysis of the high mass X-ray binary (HMXB) pulsar 4U 1907+09, based on the observations with RXTE are presented. Spin rate measurements indicate a new spin-down episode with a rate close to…

High Energy Astrophysical Phenomena · Physics 2015-05-28 S. Sahiner , S. C. Inam , A. Baykal

The molecular coordination complex NiI$_2$(3,5-lut)$_4$ [where (3,5-lut) $=$ (3,5-lutidine) $=$ (C$_7$H$_9$N)] has been synthesized and characterized by several techniques including synchrotron X-ray diffraction, ESR, SQUID magnetometry,…

The ferrimagnetic spinel $\mathrm{CoV_2O_4}$ has been a topic of intense recent interest, both as a frustrated insulator with unquenched orbital degeneracy and as a near-itinerant magnet which can be driven metallic with moderate applied…

Strongly Correlated Electrons · Physics 2016-02-03 D. Reig-i-Plessis , D. Casavant , V. O. Garlea , A. A. Aczel , M. Feygenson , J. Neuefeind , H. D. Zhou , S. E. Nagler , G. J. MacDougall

Transition metal ions provide a rich set of optically active defect spins in wide bandgap semiconductors. Chromium (Cr4+) in silicon-carbide (SiC) produces a spin-1 ground state with a narrow, spectrally isolated, spin-selective,…

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