scholarly journals Author Correction: Long-ranged Cu-based order with $$d_{z^2}$$ orbital character at a YBa2Cu3O7/manganite interface

2021 ◽  
Vol 6 (1) ◽  
Author(s):  
Roxana Gaina ◽  
Christopher W. Nicholson ◽  
Maxime Rumo ◽  
Subhrangsu Sarkar ◽  
Jarji Khmaladze ◽  
...  
Keyword(s):  

A Correction to this paper has been published: https://doi.org/10.1038/s41535-021-00323-8

2015 ◽  
Vol 10 (4) ◽  
pp. 95-99
Author(s):  
Nikolay Pavlovskii ◽  
Kirill Shaykhutdinov ◽  
Andrey Dubrovskiy ◽  
Mikhail Petrov ◽  
Konstantin Terent’ev ◽  
...  

In this report we investigate changing of magnetic properties of system (La1-zNdz)1.4Sr1.6Mn2O7 during isovalent substitution from lanthanium to neodymium at different concentration z = 0, 0.3. Decreasing of Mn-Mn in-plane distance with increasing z leads to the suppression of the ferromagnetic state that, as expected, tells us about the change of the orbital character eg – electrons with 2 2 3z r d  on the 2 2 . x y d  Also, at high applied magnetic fields metamagnetic transition observed at concentration z = 0.3, it is characterized by a sharp increase of the magnetization and the change of the ground state of the sample from the antiferromagnetic to ferromagnetic.


Catalysts ◽  
2020 ◽  
Vol 10 (3) ◽  
pp. 292
Author(s):  
Juping Wang ◽  
Kangcheng Zheng ◽  
Ting Li ◽  
Xiaojing Zhan

The reactivity, mechanism and chemoselectivity of the Mn-catalyzed intramolecular C–H amination versus C=C aziridination of allylic substrate cis-4-hexenylsulfamate are investigated by BP86 density functional theory computations. Emphasis is placed on the origins of high reactivity and high chemoselectivity of Mn catalysis. The N p orbital character of frontier orbitals, a strong electron-withdrawing porphyrazine ligand and a poor π backbonding of high-valent MnIII metal to N atom lead to high electrophilic reactivity of Mn-nitrene. The calculated energy barrier of C–H amination is 9.9 kcal/mol lower than that of C=C aziridination, which indicates that Mn-based catalysis has an excellent level of chemoselectivity towards C–H amination, well consistent with the experimental the product ratio of amintion-to-aziridination I:A (i.e., (Insertion):(Aziridination)) >20:1. This extraordinary chemoselectivity towards C–H amination originates from the structural features of porphyrazine: a rigid ligand with the big π-conjugated bond. Electron-donating substituents can further increase Mn-catalyzed C–H amination reactivity. The controlling factors found in this work may be considered as design elements for an economical and environmentally friendly C–H amination system with high reactivity and high chemoselectivity.


ACS Nano ◽  
2019 ◽  
Vol 13 (11) ◽  
pp. 12710-12718
Author(s):  
Drew W. Latzke ◽  
Claudia Ojeda-Aristizabal ◽  
Jonathan D. Denlinger ◽  
Ryan Reno ◽  
Alex Zettl ◽  
...  

2020 ◽  
Vol 4 (12) ◽  
pp. 3602-3615 ◽  
Author(s):  
Jonathan S. Ward ◽  
Andrew Danos ◽  
Patrycja Stachelek ◽  
Mark A. Fox ◽  
Andrei S. Batsanov ◽  
...  

This work shows that trifluoromethyl (CF3) substituents can be used to increase the rate of thermally activated delayed fluorescence (TADF) in conjugated organic molecules by tuning the excitonic character of the singlet and triplet excited states.


2020 ◽  
Vol 117 (28) ◽  
pp. 16219-16225 ◽  
Author(s):  
Jiemin Li ◽  
Abhishek Nag ◽  
Jonathan Pelliciari ◽  
Hannah Robarts ◽  
Andrew Walters ◽  
...  

Charge-density waves (CDWs) are ubiquitous in underdoped cuprate superconductors. As a modulation of the valence electron density, CDWs in hole-doped cuprates possess both Cu-3dand O-2porbital character owing to the strong hybridization of these orbitals near the Fermi level. Here, we investigate underdoped Bi2Sr1.4La0.6CuO6+δusing resonant inelastic X-ray scattering (RIXS) and find that a short-range CDW exists at both Cu and O sublattices in the copper-oxide (CuO2) planes with a comparable periodicity and correlation length. Furthermore, we uncover bond-stretching and bond-buckling phonon anomalies concomitant to the CDWs. Comparing to slightly overdoped Bi2Sr1.8La0.2CuO6+δ, where neither CDWs nor phonon anomalies appear, we highlight that a sharp intensity anomaly is induced in the proximity of the CDW wavevector (QCDW) for the bond-buckling phonon, in concert with the diffused intensity enhancement of the bond-stretching phonon at wavevectors much greater than QCDW. Our results provide a comprehensive picture of the quasistatic CDWs, their dispersive excitations, and associated electron-phonon anomalies, which are key for understanding the competing electronic instabilities in cuprates.


1996 ◽  
Vol 369 (1-3) ◽  
pp. L117-L121 ◽  
Author(s):  
D.A. Arena ◽  
F.G. Curti ◽  
R.A. Bartynski
Keyword(s):  

2017 ◽  
Vol 7 (1) ◽  
Author(s):  
Soobin Sinn ◽  
Kyung Dong Lee ◽  
Choong Jae Won ◽  
Ji Seop Oh ◽  
Moonsup Han ◽  
...  

1989 ◽  
Vol 156 ◽  
Author(s):  
A. J. Arko ◽  
R. S. List ◽  
R. J. Bartlett ◽  
S. W. Cheong ◽  
C. G. Olson ◽  
...  

ABSTRACTPhotoemission spectra from HTSC materials ( primarily 123 -type ), cleaved and measured at 20K, reveal a rich DOS structure which compares favorably with a calculated band structure, except for a residual 0.5 eV shift which may reflect some correlation effects. Band dispersion is observed throughout the valence bands, with clear evidence for a 0.2 eV wide band dispersing through EF. The orbital character at EF is a mix of Cu-3d and O-2p. There is unambiguous evidence for a large BCS-like gap (2Δ≥ 4kTc).


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