Solid oxygen is a unique crystal combining properties of a simple molecular solid and of a
magnet. Unlike ordinary magnets, the exchange interaction in solid oxygen acts on a …

Despite many experimental and theoretical studies, the crystal structure of the ε phase of
solid oxygen has not been determined. We performed powder x-ray diffraction experiments …

The paper provides an up-to-date review of the experimental and theoretical works on solid
oxygen published over the past decade. The most important results presented in this review …

[9] A. Fürstner, K. Radkowski, Chem. Commun. 2001, 671±672, and references therein.[10]
a) A. Fürstner, Angew. Chem. 2000, 112, 3140±3172; Angew. Chem. Int. Ed. 2000, 39 …

Solid oxygen is the only elementary molecular magnet. Under the very high pressure of 96
GPa oxygen transforms into a metal and a superconductor. Theory predicts a nonmagnetic …

Using density functional theory implemented within the generalized gradient approximation,
a new nonmagnetic insulating ground state of solid oxygen is proposed and found to be …

Despite being a staple of synthetic plastics and biomolecules, helical polymers are scarcely
studied with Gaussian-basis-set ab initio electron-correlated methods on an equal footing …

The high pressure transformation of carbon monoxide into an amorphous polymeric material
(a-pCO) is known since decades, yet the determination of its local structure is made difficult …

We report Raman measurements of solid oxygen under high static pressures up to 134 GPa
through the transition to the metallic phase. Contrary to previous studies, we observed a …

We perform first-principles molecular dynamics of liquid oxygen in which the magnetic
structure evolves according to a generalized density-functional scheme allowing for …