Related papers: Zinc in a +III oxidation state
First principles calculations of the O surfaces of Co-ZnO show that substitutional Co ions develop large magnetic moments which long-range coupling depends on their mutual distance. The local spin polarization induced at the O atoms is…
This study combines surface-sensitive photoemission experiments with density functional theory (DFT) to give a microscopic description of H adsorption-induced modifications of the ZnO(10${\overline{1}}$0) surface electronic structure. We…
The stability of high vs. low spin states of transition metal complexes has been interpreted by ligand field theory, which is a perturbation theory of the electron-electron interaction. The present first principles calculation of a series…
We present the Voigt profile analysis of 132 intervening CIV+CIII components associated with optically-thin HI absorbers at 2.1 < z < 3.4 in the 19 high-quality UVES/VLT and HIRES/Keck QSO spectra. For log N(CIV) = [11.7, 14.1], N(CIII) is…
Optical properties of compressed fluid hydrogen in the region where dissociation and metallization is observed are computed by ab-initio methods and compared to recent experimental results. We confirm that above 3000 K both processes are…
With the ability to run above 4~GeV, the BESIII experiment located in the Beijing Electron Positron Collider (BEPCII), has becoming a pioneer in searching and studying charmoniumlike states ($XYZ$ particles). In 2013, BESIII Collaboration…
The synthesis of ternary nitrides is uniquely difficult, in large part because elemental N$_2$ is relatively inert. However, lithium reacts readily with other metals and N$_2$, making Li-M-N the most numerous sub-set of ternary nitrides.…
Diffusion couples Zn/CuxTiy were prepared by the melting contact method and then annealed at 663K for various times. Using scanning electron microscopy (SEM) with energy dispersive X-ray spectroscopy (EDS), we discovered 7 new systems, i.e.…
What is the heaviest element? In order to address this question, the elements up to $Z=118$ have been synthesized by now by using heavy-ion fusion reactions. This has completed the 7th period in the periodic table of elements, and new…
Evolutionary crystal structure prediction searches have been employed to explore the ternary Li-F-H system at 300 GPa. Metastable phases were uncovered within the static lattice approximation, with LiF$_3$H$_2$, LiF$_2$H, Li$_3$F$_4$H,…
A compound with metallic electrical conductivity usually has a considerable total thermal conductivity because both electrons and photons contribute to thermal transport. Here, we show an exceptional example of iridium oxide, Bi3Ir3O11,…
We present new deep optical spectra of 9 high-z radio galaxies (HzRGs) at z > 2.7 obtained with FORS2 on VLT. These rest-frame ultraviolet spectra are used to infer the metallicity of the narrow-line regions (NLRs) in order to investigate…
The Zhang-Rice (ZR) state is a strongly hybridized bound state formed by the transition metal and oxygen atoms. The spin-fluctuations within the ZR state are known to play an important role in high-$T_\mathrm{c}$ superconductivity in…
Metallic hydrogen is capable of showing room temperature superconductivity, but its experimental syntheses are extremely hard. Therefore, it is desirable to reduce the synthesis pressure of metallic hydrogen by adding other chemical…
Production of metallic hydrogen is one of the top three open quests of physics. Recent low-temperature experiments report different metallization pressures, varying from 360GPa to 490GPa. In this work, we simulate structural properties,…
We present a detailed analysis of 99 optically thin C III absorption systems at redshift, $0.2 \le z \le 0.9$ associated with neutral hydrogen column densities in the range, $15 \le {\rm log}$ $N_{\rm H\,I}$ ($cm^{-2}$) $\le 16.2$. Using…
We present a high S/N ratio optical spectrum of the bright quasar HS1700+6416. These data usefully complement the UV HST data from Vogel and Reimers (1995). We analyse the metal line systems using photo-ionization models allowing for…
Highly charged ions (HCIs) are insensitive to external perturbations and are attractive for the development of ultrastable clocks. However, only a few HCI candidates are known to provide optical clock transitions. In this Letter, we show…
Intermetallic semiconductors with the cubic Half-Heusler structure (XYZ) have excellent thermoelectric properties. This has been attributed to the high degeneracy of the carrier pockets in the band structure, but large differences are found…
We have investigated energies and spectroscopic properties such as lifetimes, $g_J$ factors, and hyperfine structure constants of the neutral atoms P through Mc belonging to Group-15, singly ionized atoms S$^+$ through Lv$^+$ of Group-16…