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 ...

X-rays uncover magnetic phenomena that are driven by interactions between the layers of a kagome ferromagnet. Our ...

Researchers at EPFL have found a way to dramatically reduce energy loss and boost efficiency in perovskite solar cells by ...

The electronic structure package for quantum computers.

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

This created a stable compound, allowing the researchers to use X-ray absorption spectroscopy to measure the length of the ...

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

Precious metals are not merely ornaments; they are also important components of pharmaceuticals, like the antitumor drug ...

Precious metals are not merely ornaments; they are also important components of pharmaceuticals, like the antitumor drug cisplatin. Recently, the search for alternatives with improved activity has ...

Solar energy is one of the most promising solutions for reducing our dependence on fossil fuels. But making solar panels more ...

It can only add single bits at a time and is limited to kilohertz clock speeds, but it is capable of executing the full ...

Controlling magnetism in a device is not easy; unusually large magnetic fields or lots of electricity are needed, which are ...