Clathrate metal superhydrides under high-pressure conditions: enroute to room-temperature superconductivity
Room-temperature superconductivity has been a long-held dream of mankind and a focus of
considerable interest in the research field of superconductivity. Significant progress has …
considerable interest in the research field of superconductivity. Significant progress has …
Hydrogen clathrate structures in rare earth hydrides at high pressures: possible route to room-temperature superconductivity
Room-temperature superconductivity has been a long-held dream and an area of intensive
research. Recent experimental findings of superconductivity at 200 K in highly compressed …
research. Recent experimental findings of superconductivity at 200 K in highly compressed …
Ab initio Eliashberg theory: making genuine predictions of superconducting features
We present an application of Eliashberg theory of superconductivity to study a set of novel
superconducting systems with a wide range of structural and chemical properties. The set …
superconducting systems with a wide range of structural and chemical properties. The set …
Prediction of above-room-temperature superconductivity in lanthanide/actinide extreme superhydrides
Achieving room-temperature superconductivity has been an enduring scientific pursuit
driven by broad fundamental interest and enticing potential applications. The recent …
driven by broad fundamental interest and enticing potential applications. The recent …
High-pressure hydrogen sulfide from first principles: a strongly anharmonic phonon-mediated superconductor
We use first-principles calculations to study structural, vibrational, and superconducting
properties of H 2 S at pressures P≥ 200 GPa. The inclusion of zero-point energy leads to …
properties of H 2 S at pressures P≥ 200 GPa. The inclusion of zero-point energy leads to …
Potential high- superconductivity in under pressure
The high-pressure phases and superconductivity of CaYH 12 have been explored by using
a particle swarm optimization structure prediction methodology in combination with first …
a particle swarm optimization structure prediction methodology in combination with first …
High-temperature superconductivity in alkaline and rare earth polyhydrides at high pressure: A theoretical perspective
The theoretical exploration of the phase diagrams of binary hydrides under pressure using
ab initio crystal structure prediction techniques coupled with first principles calculations has …
ab initio crystal structure prediction techniques coupled with first principles calculations has …
Computational discovery of a dynamically stable cubic -like high-temperature superconductor at 100 GPa via intercalation
The 203 K superconductivity of SH 3 stimulates enormous interest in searching for high-
temperature superconductors in compressed hydrides. While several hydrides show high …
temperature superconductors in compressed hydrides. While several hydrides show high …
High temperature superconductivity in sulfur and selenium hydrides at high pressure
Due to its low atomic mass, hydrogen is the most promising element to search for high-
temperature phononic superconductors. However, metallic phases of hydrogen are only …
temperature phononic superconductors. However, metallic phases of hydrogen are only …
Superconducting high pressure phase of germane
High-pressure structures of germane (GeH 4) are explored through ab initio evolutionary
methodology to reveal a metallic monoclinic structure of C 2/c (4 molecules/cell). The C 2/c …
methodology to reveal a metallic monoclinic structure of C 2/c (4 molecules/cell). The C 2/c …