Skip to Content

Magnetochemistry, Volume 9, Issue 4

2023 April - 24 articles

Cover Story: An improved approach to obtaining reliable NMR spectroscopic parameters for platinum complexes is presented. By developing and validating an AMBER force field for such complexes conjugated with AHBT, molecular dynamics simulations were carried out in enzymatic and aqueous environments, and strategies to select the best amino acid residues and water molecules were proposed. The results obtained show that this methodology allows for the acquisition of more reliable chemical shifts and spectroscopic probes, with significant differences observed between these two surroundings. View this paper
  • Issues are regarded as officially published after their release is announced to the table of contents alert mailing list .
  • You may sign up for email alerts to receive table of contents of newly released issues.
  • PDF is the official format for papers published in both, html and pdf forms. To view the papers in pdf format, click on the "PDF Full-text" link, and use the free Adobe Reader to open them.

Articles (24)

  • Perspective
  • Open Access
17 Citations
13,032 Views
11 Pages

MRI Quantitative Evaluation of Muscle Fatty Infiltration

  • Vito Chianca,
  • Bottino Vincenzo,
  • Renato Cuocolo,
  • Marcello Zappia,
  • Salvatore Guarino,
  • Francesco Di Pietto and
  • Filippo Del Grande

Magnetic resonance imaging (MRI) is the gold-standard technique for evaluating muscle fatty infiltration and muscle atrophy due to its high contrast resolution. It can differentiate muscular from adipose tissue accurately. MRI can also quantify the a...

(This article belongs to the Section Magnetic Resonances)
  • Review
  • Open Access
203 Citations
21,330 Views
32 Pages

Recent Advances of Magnetite (Fe3O4)-Based Magnetic Materials in Catalytic Applications

  • Mingyue Liu,
  • Yuyuan Ye,
  • Jiamin Ye,
  • Ting Gao,
  • Dehua Wang,
  • Gang Chen and
  • Zhenjun Song

Catalysts play a critical role in producing most industrial chemicals and are essential to environmental remediation. Under the demands of sustainable development, environment protection, and cost-related factors, it has been suggested that catalysts...

(This article belongs to the Section Magnetic Materials)
  • Feature Paper
  • Article
  • Open Access
8 Citations
3,996 Views
10 Pages

The intrinsic magnetic properties (magnetic moments, magneto-crystalline anisotropy, Curie temperatures) of the (Fe1−xMx)2B alloys have been calculated using the spin-polarized relativistic Korringa–Kohn–Rostoker (SPR-KKR) band stru...

(This article belongs to the Special Issue Soft and Hard Magnetic Materials: Latest Advances and Prospects)
  • Article
  • Open Access
10 Citations
4,307 Views
14 Pages

Structural, Elastic, Electronic, and Magnetic Properties of Full-Heusler Alloys Sc2TiAl and Sc2TiSi Using the FP-LAPW Method

  • Khadejah M. Al-Masri,
  • Mohammed S. Abu-Jafar,
  • Mahmoud Farout,
  • Diana Dahliah,
  • Ahmad A. Mousa,
  • Said M. Azar and
  • Rabah Khenata

In this article, the structural, elastic, electronic, and magnetic characteristics of both regular and inverse Heusler alloys, Sc2TiAl and Sc2TiSi, were investigated using a full-potential, linearized augmented plane-wave (FP-LAPW) method, within the...

(This article belongs to the Special Issue Editorial Board Members’ Collection Series: Magnetic and Magnetoelectric Materials)
  • Article
  • Open Access
9 Citations
3,309 Views
13 Pages

Study of the Effects of Er Doping on the Physical Properties of CdSe Thin Films

  • Yuliana de Jesús Acosta-Silva,
  • Luis A. Godínez,
  • Manuel Toledano-Ayala,
  • Rosendo Lozada-Morales,
  • Orlando Zelaya-Angel and
  • Arturo Méndez-López

Erbium-doped cadmium selenide thin films grown on 7059 Corning glass by means of a chemical bath at 80 °C were prepared. Doping was performed by adding an aqueous Er(NO3)33·H2O dilution to the CdSe growth solution. The volume of Er doping...

(This article belongs to the Special Issue Magnetic Materials, Thin Films and Nanostructures)
  • Article
  • Open Access
24 Citations
4,767 Views
16 Pages

Nylon-6-Coated Doxorubicin-Loaded Magnetic Nanoparticles and Nanocapsules for Cancer Treatment

  • Ekaterina Kovrigina,
  • Yuliya Poletaeva,
  • Yanfang Zheng,
  • Alexey Chubarov and
  • Elena Dmitrienko

Nanoplatforms used for the loading of anticancer drugs constitute a promising approach to cancer treatment and reducing the side effects of these drugs. Among the cutting-edge systems used in this area are magnetic nanocomposites (MNCs) and nanocapsu...

(This article belongs to the Section Magnetic Nanospecies)
  • Article
  • Open Access
3 Citations
2,962 Views
11 Pages

Zero-Field Slow Magnetic Relaxation in Binuclear Dy Acetylacetonate Complex with Pyridine-N-Oxide

  • Valeriya P. Shtefanets,
  • Gennady V. Shilov,
  • Denis V. Korchagin,
  • Elena A. Yureva,
  • Alexei I. Dmitriev,
  • Mikhail V. Zhidkov,
  • Roman B. Morgunov,
  • Nataliya A. Sanina and
  • Sergey M. Aldoshin

A new complex [Dy(C5H7O2)3(C5H5NO)]2·2CHCl3 (1) has been synthesized by the reaction of pyridine-N-oxide with dysprosium (III) acetylacetonate in an n-heptane/chloroform mixture (1/20). X-ray data show that each dysprosium atom is chelate-like...

(This article belongs to the Section Molecular Magnetism)
  • Communication
  • Open Access
4 Citations
3,771 Views
8 Pages

An Optical Spectroscopic Study of Air-Degradation of van der Waals Magnetic Semiconductor Cr2Ge2Te6

  • Woye Pei,
  • Zhiren Xiong,
  • Yingjia Liu,
  • Xingguang Wu,
  • Zheng Vitto Han,
  • Siwen Zhao and
  • Tongyao Zhang

Two-dimensional (2D) magnetic semiconductors exhibit unique combination of electronic and magnetic properties, holding great promise in potential applications such as spintronics and magneto-optics. However, many of them are air-sensitive, and their...

(This article belongs to the Special Issue Advances in Magnetic Two Dimensional Materials)
  • Article
  • Open Access
2 Citations
2,333 Views
14 Pages

The microstructure and magnetic properties of methane (CH4) heat-treated Sr-hexaferrite powders during the re-calcination process were investigated and compared with the magnetic properties of conventionally synthesized Sr-hexaferrite powder. Gradual...

(This article belongs to the Section Applications of Magnetism and Magnetic Materials)
  • Feature Paper
  • Article
  • Open Access
14 Citations
5,139 Views
14 Pages

In this work, 242 NMR spin–spin coupling constants (SSCC) in 20 molecules are calculated, either with correlated wave function methods, SOPPA and HRPA(D), or with density functional theory based on the B3LYP, BHandH, or PBE0 functionals. The ca...

(This article belongs to the Special Issue Computational Chemistry in Nuclear Magnetic Resonance)
  • Article
  • Open Access
2 Citations
2,965 Views
14 Pages

By employing GPU-implemented hybrid Monte Carlo simulations, we study the robustness of the skyrmion lattice phase (SkX) in a frustrated Heisenberg antiferromagnetic (AFM) layer on a triangular lattice with a Dzyaloshinskii–Moriya interaction i...

(This article belongs to the Special Issue Phase Change Material and Magnetic Research)
  • Feature Paper
  • Article
  • Open Access
19 Citations
6,638 Views
31 Pages

Zero-Field Splitting in Hexacoordinate Co(II) Complexes

  • Roman Boča,
  • Cyril Rajnák and
  • Ján Titiš

A collection of 24 hexacoordinate Co(II) complexes was investigated by ab initio CASSCF + NEVPT2 + SOC calculations. In addition to the energies of spin–orbit multiplets (Kramers doublets, KD) their composition of the spins is also analyzed, al...

(This article belongs to the Section Molecular Magnetism)
  • Article
  • Open Access
8 Citations
3,994 Views
22 Pages

Investigation of Cubic and Spherical IONPs’ Rheological Characteristics and Aggregation Patterns from the Perspective of Magnetic Targeting

  • Maria-Cristina Ioncica,
  • Sulalit Bandyopadhyay,
  • Nesrine Bali,
  • Vlad Socoliuc and
  • Sandor I. Bernad

Based on our prior research, we synthesized iron-oxide nanoparticles (IONPs) in two shapes (spherical and cubic) and sized them for the current inquiry. This research examined the magnetic, rheological, and sedimentation properties of the suspensions...

(This article belongs to the Section Applications of Magnetism and Magnetic Materials)
  • Article
  • Open Access
5 Citations
3,142 Views
10 Pages

An Effect of Fe3+ Ion Substitution for Cr3+ in the Octahedral Sites of FeCr2O4 Multiferroic Spinel: Mössbauer Spectroscopy Study

  • Almaz L. Zinnatullin,
  • Mikhail A. Cherosov,
  • Ruslan G. Batulin,
  • Farit G. Vagizov and
  • Roman V. Yusupov

We present the results of a successful synthesis and investigation of polycrystalline Fe2+(Cr3+, Fe3+)2O4 powder, where 1/8 part of the Cr3+ ions in the octahedral sites is substituted by the Fe3+ ones. It is shown that under such doping, the materia...

(This article belongs to the Special Issue Phase Change Material and Magnetic Research)
  • Article
  • Open Access
5 Citations
4,979 Views
19 Pages

Traditional dc magnetron sputtering has a low ionization rate when preparing metallic thin films. With the development of thin film science and the market demand for thin film material applications, it is necessary to improve the density of magnetron...

(This article belongs to the Section Magnetic Field)
  • Article
  • Open Access
3 Citations
3,319 Views
24 Pages

We study the latitudinal extent of the near-relativistic electron events of 10 June 2000 and 26 December 2001, observed by both Ulysses and ACE. From the observations it is shown that the intensity of ACE was quite different from that of Ulysses. Thr...

(This article belongs to the Special Issue Magnetodynamics of Space Plasmas)
  • Feature Paper
  • Article
  • Open Access
7 Citations
2,804 Views
15 Pages

Nonreciprocity of Optical Absorption in the Magnetoelectric Antiferromagnet CuB2O4

  • Kirill N. Boldyrev,
  • Anastasiia D. Molchanova,
  • Alexey R. Nurmukhametov,
  • Mikhail V. Eremin,
  • Roman V. Pisarev and
  • Marina N. Popova

The change in the absorption spectra due to reversal of the direction of light propagation (nonreciprocity of absorption) is a consequence of a simultaneous violation of both time-reversal and spatial-inversion symmetries. Here, we report on a high-r...

(This article belongs to the Section Magnetic Materials)
  • Communication
  • Open Access
3 Citations
2,574 Views
8 Pages

Magnetoelectric Properties of Ni-PZT-Ni Heterostructures Obtained by Electrochemical Deposition of Nickel in an External Magnetic Field

  • Natalia Poddubnaya,
  • Dmitry Filippov,
  • Vladimir Laletin,
  • Aliaksei Aplevich and
  • Kazimir Yanushkevich

This paper studied the influence of external electric and magnetic fields on the magnetoelectric properties of layered structures of metal-piezoelectric-metal. The structures under study had the shape of a square 4 mm wide and were obtained in two st...

(This article belongs to the Special Issue Editorial Board Members’ Collection Series: Magnetic and Magnetoelectric Materials)
  • Article
  • Open Access
2 Citations
2,426 Views
18 Pages

PTA-Welded Coatings with Saturation Magnetization above 1.3 T Using FeCrBSi Powders with Chemical Composition Similar to AISI 430 Ferrite Stainless Steel

  • Yingqing Fu,
  • Haiming Wang,
  • Wenhao Huang,
  • Zhoujian Pan,
  • Changhao Liu,
  • Lei Zhao,
  • Chao Li,
  • Liangyu Zhu and
  • Naibao Huang

Fe-Cr-based soft magnetic alloy (SMA) monolayer coatings with high saturation magnetization (Ms) above 1.3 T were deposited onto AISI 1010 substrate by co-axial powder feeding plasma transferred arc (PTA) welding, using FeCrBSi self-fluxing powders F...

(This article belongs to the Special Issue Recent Research on Ferromagnetic Materials)
  • Article
  • Open Access
14 Citations
3,934 Views
16 Pages

Synthesis and Characterization of Magnetic Molecularly Imprinted Polymer for the Monitoring of Amoxicillin in Real Samples Using the Chromatographic Method

  • Rosario López,
  • Sabir Khan,
  • Sergio Espinoza Torres,
  • Ademar Wong,
  • Maria D. P. T. Sotomayor and
  • Gino Picasso

Amoxicillin (AMX) is an antibiotic frequently used for the treatment of bacterial disorders and respiratory problems in both humans and animals. This work aims to synthesize a molecularly imprinted superparamagnetic polymer (SP-MIP) with a core-shell...

(This article belongs to the Section Magnetic Nanospecies)
  • Article
  • Open Access
1 Citations
2,227 Views
17 Pages

Solar energetic particles (SEPs) are produced by solar eruptions and are harmful to spacecraft and astronauts. The four source function parameters of particle injection for SEP events and the magnetic turbulence level can be collectively referred to...

(This article belongs to the Special Issue Magnetodynamics of Space Plasmas)
  • Review
  • Open Access
46 Citations
10,911 Views
26 Pages

Magnetorheological dampers (MRDs) use the controlled rheological properties of MRF with the action of an applied magnetic field to achieve lower current regulation and control larger damping. MRD technology is applied to the defense industry, vehicle...

(This article belongs to the Section Applications of Magnetism and Magnetic Materials)
  • Article
  • Open Access
7 Citations
2,779 Views
12 Pages

Improving the Path to Obtain Spectroscopic Parameters for the PI3K—(Platinum Complex) System: Theoretical Evidences for Using 195Pt NMR as a Probe

  • Taináh M. R. Santos,
  • Gustavo A. Andolpho,
  • Camila A. Tavares,
  • Mateus A. Gonçalves and
  • Teodorico C. Ramalho

The absence of adequate force field (FF) parameters to describe certain metallic complexes makes new and deeper analyses impossible. In this context, after a group of researchers developed and validated an AMBER FF for a platinum complex (PC) conjuga...

(This article belongs to the Special Issue Nuclear Magnetic Resonance Spectroscopy in Coordination Compounds)
  • Article
  • Open Access
4 Citations
2,625 Views
11 Pages

The Relationship between Solar Wind Charge Exchange Soft X-ray Emission and the Tangent Direction of Magnetopause in an XMM–Newton Event

  • Yingjie Zhang,
  • Tianran Sun,
  • Jennifer A. Carter,
  • Wenhao Liu,
  • Steve Sembay,
  • Li Ji and
  • Chi Wang

With the advent of soft X-ray imaging enabling global magnetopause detection, it is critical to use reconstruction techniques to derive the 3-dimensional magnetopause location from 2-dimensional X-ray images. One of the important assumptions adopted...

(This article belongs to the Special Issue Magnetodynamics of Space Plasmas)
XFacebookLinkedIn
Magnetochemistry - ISSN 2312-7481