Main repository for QMCPACK, an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic structure of atoms, molecules, and solids with full performance ...

Controlling the arrangement of atomic vacancies offers a new way to adjust electronic, magnetic, thermal, and hydrogen ...

Researchers have found a way to dramatically reducing energy loss and boosting efficiency perovskite solar cells by incorporating rubidium using lattice strain - a slight deformation in the atomic ...

Carbon's allotropes, like graphene and nanotubes, offer superior properties for quantum computing, driving energy efficiency ...

Green hydrogen from water splitting has emerged as a critical energy vector with the potential to spearhead the global ...

A new study published in Nature Communications April 7 could reshape the future of magnetic and electronic technology. Scientists at Rice University have discovered how a disappearing electronic ...

Argonne scientists have unveiled new methods for controlling material properties. The breakthrough enables researchers to ...

A RIKEN study shows that squeezing the right amount of potassium ions between the atomic layers of molybdenum disulfide can turn it from a semiconductor into a metal, superconductor or insulator. The ...

For many years, physics studies focused on two main types of magnetism, namely ferromagnetism and antiferromagnetism. The ...

A section of the atomic structure of a cadmium selenide ... but also their optical and electronic properties. These places often have a high concentration of charge carriers, which can affect their ...

A chemical treatment using DSH prevents light-induced degradation in mixed halide perovskites, paving the way for more stable ...

For the first time, scientists have caught a glimpse of a strange and elusive creature in the world of quantum physics—a semi ...