Polynuclear transition metal complexes have continuously attracted interest owing to their peculiar electronic and magnetic properties which are influenced by the symmetry and connectivity of the metal centres. Understanding the full electronic picture in such cases often becomes difficult owing to the presence of multiple bridges between metal centres. We have investigated the electronic structure of a {Mn6} cage complex using computational and experimental approaches with the aim to understand the coupling between the manganese centres. The nature of the various coupling pathways has been determined using a novel methodology that involves perturbing the system while retaining the symmetry and analysing the effect on the coupling strength due to the perturbation. Furthermore, we have investigated the magnetic properties of this complex in higher oxidation states which reveals a switch in the nature of coupling from antiferromagnetic to ferromagnetic in addition to stabilisation of intermediate spin states.
Download full-text PDF |
Source |
|---|---|
| http://dx.doi.org/10.1039/d0dt01404d | DOI Listing |
Publication Analysis
Top Keywords
Similar Publications
Comparison of the rhizospheric soil bacteriomes of Oryza sativa and Solanum melongena crop cultivars reveals key genes and pathways involved in biosynthesis of ectoine, lysine, and catechol meta-cleavage.
Funct Integr Genomics
January 2025
Department of Zoology, University of Gour Banga, Malda, 732103, India.
Rice (Oryza sativa L.), Poaceae family, forms staple diet of half of world's population, and brinjal (Solanum melongena L.), an important solanaceous crop, are consumed worldwide.
View Article and Find Full Text PDFHeterogeneous copper-catalyzed Grignard reactions with allylic substrates.
Chem Commun (Camb)
January 2025
Department of Organic Chemistry, Arrhenius Laboratory, Stockholm University, Stockholm, SE-10691, Sweden.
Herein, we present a highly efficient allylic substitution of carbonates with Grignard reagents using a reusable cellulose-supported nanocopper catalyst. This approach highlights the first instance of heterogeneous catalysis for the cross-coupling of allylic alcohol substrates with Grignard reagents. The method features high yields, excellent regioselectivity, and complete chirality transfer.
View Article and Find Full Text PDFAdvancing Soft Robot Proprioception Through 6D Strain Sensors Embedding.
Soft Robot
January 2025
Department of Mechanical and Nuclear Engineering, Khalifa University of Science and Technology, Abu Dhabi, United Arab Emirates.
Soft robots and bioinspired systems have revolutionized robot design by incorporating flexibility and deformable materials inspired by nature's ingenious designs. Similar to many robotic applications, sensing and perception are paramount to enable soft robots to adeptly navigate the unpredictable real world, ensuring safe interactions with both humans and the environment. Despite recent progress, soft robot sensorization still faces significant challenges due to the virtual infinite degrees of freedom of the system and the need for efficient computational models capable of estimating valuable information from sensor data.
View Article and Find Full Text PDFNanoscopic acoustic vibrational dynamics of a single virus captured by ultrafast spectroscopy.
Proc Natl Acad Sci U S A
January 2025
Department of Chemistry, Michigan State University, East Lansing, MI 48824.
The natural vibrational frequencies of biological particles such as viruses and bacteria encode critical information about their mechanical and biological states as they interact with their local environment and undergo structural evolution. However, detecting and tracking these vibrations within a biological context at the single particle level has remained elusive. In this study, we track the vibrational motions of single, unlabeled virus particles under ambient conditions using ultrafast spectroscopy.
View Article and Find Full Text PDFA 1D coordination compound made of a photochromic dithienylethene linker and [Dy(Tp2-py)F]+ units (with Tp2-py = tris(3-(2-pyridyl)pyrazolyl)hydroborate) and having tetrakis[3,5-bis(trifluoromethyl)phenyl]borate counterions is reported. Full photoconversion from the closed isomer to the open isomer of the dithienyethene within single crystals allow for monitoring of the transformation by photocrystallography. Magnetic slow relaxation as well as magnetic hysteresis are observed and can be both modulated upon light irradiation.
View Article and Find Full Text PDFWant AI Summaries of new PubMed Abstracts delivered to your In-box?
Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!