Chemistry under high pressure
Thanks to the development of experimental high-pressure techniques and methods for
crystal-structure prediction based on quantum mechanics, in the past decade, numerous …
crystal-structure prediction based on quantum mechanics, in the past decade, numerous …
Materials by design at high pressures
Pressure, a fundamental thermodynamic variable, can generate two essential effects on
materials. First, pressure can create new high-pressure phases via modification of the …
materials. First, pressure can create new high-pressure phases via modification of the …
A map of the inorganic ternary metal nitrides
Exploratory synthesis in new chemical spaces is the essence of solid-state chemistry.
However, uncharted chemical spaces can be difficult to navigate, especially when materials …
However, uncharted chemical spaces can be difficult to navigate, especially when materials …
Rh19−: A high-spin super-octahedron cluster
Probing atomic clusters with magic numbers is of supreme importance but challenging in
cluster science. Pronounced stability of a metal cluster often arises from coincident …
cluster science. Pronounced stability of a metal cluster often arises from coincident …
Fe-N system at high pressure reveals a compound featuring polymeric nitrogen chains
Poly-nitrogen compounds have been considered as potential high energy density materials
for a long time due to the large number of energetic N–N or N= N bonds. In most cases high …
for a long time due to the large number of energetic N–N or N= N bonds. In most cases high …
Synthesis of magnesium-nitrogen salts of polynitrogen anions
The synthesis of polynitrogen compounds is of fundamental importance due to their potential
as environmentally-friendly high energy density materials. Attesting to the intrinsic difficulties …
as environmentally-friendly high energy density materials. Attesting to the intrinsic difficulties …
Stabilized nitrogen framework anions in the Ga–N system
Nitrogen-rich compounds have attracted significant fundamental and practical interest owing
to their ability to accommodate diverse nitrogen-bonding patterns and their feasibility as high …
to their ability to accommodate diverse nitrogen-bonding patterns and their feasibility as high …
Predictions on high-power trivalent metal pentazolate salts
High-energy-density materials (HEDMs) have been intensively studied for their significance
in fundamental sciences and practical applications. Here, using the molecular crystal …
in fundamental sciences and practical applications. Here, using the molecular crystal …
Pressure-stabilized high-energy-density alkaline-earth-metal pentazolate salts
Polynitrogen compounds especially pentazolate anion complexes recently have attracted
substantial attention due to their promising potential as high-energy-density materials. Here …
substantial attention due to their promising potential as high-energy-density materials. Here …
Barium–nitrogen phases under pressure: Emergence of structural diversity and nitrogen-rich compounds
Although the potential of polynitrogen as a high-energy density material (HEDM) has
attracted attention, the difficulty of preserving polynitrogen thwarts attempts to discover …
attracted attention, the difficulty of preserving polynitrogen thwarts attempts to discover …