Abstract
First Page
Keywords
Affiliated Institutions
Related Publications
First-principles calculations of the ferroelastic transition between rutile-type and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mtext>CaCl</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>-type<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mtext>SiO</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>at high pressures
The tetragonal to orthorhombic ferroelastic phase transition between rutile- and CaCl2-type SiO2 at high pressures is studied using first-principles calculations and the Landau ...
Structural Transitions in Superionic Conductors
The $\ensuremath{\alpha}\ensuremath{\rightleftarrows}\ensuremath{\beta}$ phase transition in AgI is studied with use of the new molecular-dynamics technique which allows for a d...
Phonon softening in paramagnetic bcc Fe and its relationship to the pressure-induced phase transition
Structural stability of paramagnetic (PM) body-centered cubic (bcc) Fe under\npressure is investigated based on first-principles phonon calculations. Spin\nconfigurations of the...
Evolution of crystal structures in metallic elements
Crystal structures of metals are often treated as dense packing of atomic spheres. Face-centered cubic and hexagonal close-packed structures are favored in many metals. Long-per...
Transition pathway of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mi mathvariant="normal">C</mml:mi><mml:msub><mml:mi mathvariant="normal">O</mml:mi><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>crystals under high pressures
The pressure-induced transitions from molecular to nonmolecular CO2 crystals are systematically investigated by using first-principles lattice dynamics calculations. Geometrical...
Publication Info
- Year
- 1957
- Type
- article
- Volume
- 27
- Issue
- 5
- Pages
- 1208-1209
- Citations
- 2509
- Access
- Closed
External Links
Social Impact
Social media, news, blog, policy document mentions
Citation Metrics
Cite This
Identifiers
- DOI
- 10.1063/1.1743957