[HTML][HTML] Discovery of new materials using combinatorial synthesis and high-throughput characterization of thin-film materials libraries combined with computational …
A Ludwig - NPJ Computational Materials, 2019 - nature.com
This perspective provides an experimentalist's view on materials discovery in multinary
materials systems—from nanoparticles over thin films to bulk—based on combinatorial thin …
materials systems—from nanoparticles over thin films to bulk—based on combinatorial thin …
Intermetalloid and heterometallic clusters combining p-block (semi) metals with d-or f-block metals
RJ Wilson, N Lichtenberger, B Weinert… - Chemical …, 2019 - ACS Publications
Clusters have been the subject of intense investigations since their famous definition
launched by Cotton in 1963, and the area has expanded ever since. One obvious …
launched by Cotton in 1963, and the area has expanded ever since. One obvious …
Materials under high pressure: a chemical perspective
At high pressure, the typical behavior of elements dictated by the periodic table—including
oxidation numbers, stoichiometries in compounds, and reactivity, to name but a few—is …
oxidation numbers, stoichiometries in compounds, and reactivity, to name but a few—is …
High-pressure synthesis: a new frontier in the search for next-generation intermetallic compounds
JPS Walsh, DE Freedman - Accounts of chemical research, 2018 - ACS Publications
Conspectus The application of high pressure adds an additional dimension to chemical
phase space, opening up an unexplored expanse bearing tremendous potential for …
phase space, opening up an unexplored expanse bearing tremendous potential for …
Computationally Directed Discovery of MoBi2
Incorporating bismuth, the heaviest element stable to radioactive decay, into new materials
enables the creation of emergent properties such as permanent magnetism …
enables the creation of emergent properties such as permanent magnetism …
Crystal Structure Determination from Powder Diffraction Patterns with Generative Machine Learning
Powder X-ray diffraction (PXRD) is a cornerstone technique in materials characterization.
However, complete structure determination from PXRD patterns alone remains time …
However, complete structure determination from PXRD patterns alone remains time …
Creating binary Cu–Bi compounds via high-pressure synthesis: a combined experimental and theoretical study
Exploration beyond the known phase space of thermodynamically stable compounds into
the realm of metastable materials is a frontier of materials chemistry. The application of high …
the realm of metastable materials is a frontier of materials chemistry. The application of high …
Exploring the high-pressure materials genome
A thorough in situ characterization of materials at extreme conditions is challenging, and
computational tools such as crystal structural search methods in combination with ab initio …
computational tools such as crystal structural search methods in combination with ab initio …
[Co@Sn6Sb6]3−: An Off‐Center Endohedral 12‐Vertex Cluster
RJ Wilson, F Hastreiter, K Reiter… - Angewandte Chemie …, 2018 - Wiley Online Library
We report on the asymmetric occupation of a 12‐vertex cluster centered by a single metal
atom. Three salts of related intermetalloid cluster anions,[Co@ Sn6Sb6] 3−(1),[Co2 …
atom. Three salts of related intermetalloid cluster anions,[Co@ Sn6Sb6] 3−(1),[Co2 …
Bismuth as a reactive solvent in the synthesis of multicomponent transition-metal-bearing bismuthides
A Ovchinnikov, S Bobev - Inorganic Chemistry, 2019 - ACS Publications
Employment of liquid bismuth (Bi) allows the facile single-crystal growth of compounds
containing elements with high melting points, provided that these elements have reasonably …
containing elements with high melting points, provided that these elements have reasonably …