scholarly journals Determination of conduction and valence band electronic structure of anatase and rutile TiO 2

2014 ◽  
Vol 126 (2) ◽  
pp. 511-515 ◽  
Author(s):  
JAKUB SZLACHETKO ◽  
KATARZYNA MICHALOW-MAUKE ◽  
MAARTEN NACHTEGAAL ◽  
JACINTO SÁ
ChemSusChem ◽  
2017 ◽  
Vol 10 (9) ◽  
pp. 2099-2106 ◽  
Author(s):  
Markus Pichler ◽  
Jakub Szlachetko ◽  
Ivano E. Castelli ◽  
Nicola Marzari ◽  
Max Döbeli ◽  
...  

2021 ◽  
Author(s):  
Giorgia Olivieri ◽  
Gregor Kladnik ◽  
Dean Cvetko ◽  
Matthew A. Brown

The electronic structure of hydrated nanoparticles can be unveiled by coupling a liquid microjet with a resonant photoemission spectroscopy.


1989 ◽  
Vol 53 (370) ◽  
pp. 153-164 ◽  
Author(s):  
David S. Urch

AbstractX-ray photoelectron spectroscopy can be used to measure the ionization energies of electrons in both valence band and core orbitals. As core vacancies are the initial states for X-ray emission, a knowledge of their energies for all atoms in a mineral enables all the X-ray spectra to be placed on a common energy scale. X-ray spectra are atom specific and are governed by the dipole selection rule. Thus the individual bonding roles of the different atoms are revealed by the fine structure of valence X-ray peaks (i.e. peaks which result from electron transitions between valence band orbitals and core vacancies). The juxtaposition of such spectra enables the composition of the molecular orbitals that make up the chemical bonds of a mineral to be determined.Examples of this approach to the direct determination of electronic structure are given for silica, forsterite, brucite, and pyrite. Multi-electron effects and developments involving anisotropic X-ray emission from single crystals are also discussed.


RSC Advances ◽  
2014 ◽  
Vol 4 (22) ◽  
pp. 11420 ◽  
Author(s):  
Jakub Szlachetko ◽  
Markus Pichler ◽  
Daniele Pergolesi ◽  
Jacinto Sá ◽  
Thomas Lippert

1991 ◽  
Vol 240 ◽  
Author(s):  
Emil S. Koteies

ABSTRACTWe have developed a novel experimental technique for accurately determining band offsets in semiconductor quantum wells (QW). It is based on the fact that the ground state heavy- hole (HH) band energy is more sensitive to the depth of the valence band well than the light-hole (LH) band energy. Further, it is well known that as a function of the well width, Lz, the energy difference between the LH and HH excitons in a lattice matched, unstrained QW system experiences a maximum. Calculations show that the position, and more importantly, the magnitude of this maximum is a sensitive function of the valence band offset, Qy, which determines the depth of the valence band well. By fitting experimentally measured LH-HH splittings as a function of Lz, an accurate determination of band offsets can be derived. We further reduce the experimental uncertainty by plotting LH-HH as a function of HH energy (which is a function of Lz ) rather than Lz itself, since then all of the relevant parameters can be precisely determined from absorption spectroscopy alone. Using this technique, we have derived the conduction band offsets for several material systems and, where a consensus has developed, have obtained values in good agreement with other determinations.


1997 ◽  
Vol 9 (14) ◽  
pp. 2955-2961 ◽  
Author(s):  
D Brown ◽  
M D Crapper ◽  
K H Bedwell ◽  
M Petty ◽  
J G Smith ◽  
...  

1992 ◽  
Vol 46 (3) ◽  
pp. 1886-1888 ◽  
Author(s):  
Gérald Arnaud ◽  
Philippe Boring ◽  
Bernard Gil ◽  
Jean-Charles Garcia ◽  
Jean-Pierre Landesman ◽  
...  

2016 ◽  
Vol 45 (31) ◽  
pp. 12576-12586 ◽  
Author(s):  
Khrystyna Herasymchuk ◽  
Linus Chiang ◽  
Cassandra E. Hayes ◽  
Matthew L. Brown ◽  
Jeffrey S. Ovens ◽  
...  

Pentagonal bipyramidal uranyl (UO22+) complexes of salen ligands were prepared and the electronic structure of the one-electron oxidized species[1a–c]+were investigated in solution.


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