Figure 1. Various methodologies are utilized in the simulation of materials and materials, such as quantum mechanical calculations at the nanometer (nm) level, classical mechanical force fields at the ...

Quantum mechanical calculations of atomic systems comprise a suite of computational methods that rigorously apply the principles of quantum mechanics to determine a range of atomic properties. These ...

Performing complex algorithms on quantum computers will eventually require access to tens of thousands of hardware qubits. For most of the technologies being developed, this creates a problem: It’s ...

Inside what looks like a simple block of frozen water, quantum mechanics is quietly rewriting the rules of chemistry. New calculations are revealing how protons tunnel, bonds flicker and molecules ...

Accelerate the future of technology by studying one of the world’s most cutting-edge fields: quantum information science and engineering (QISE). This exciting discipline is at the forefront of today’s ...

Stress is a very real factor in the structure of our universe. Not the kind of stress that students experience when taking a test, but rather the physical stresses that affect everyday objects.

The simplified formula was developed to analyze local quantum entanglement in nanoscale materials. Credit: Osaka Metropolitan University Once described by Einstein as "spooky action at a distance," ...

Achieving state-of-the-art accuracy in molecular property prediction using self-supervised AI, enabling cost-effective modeling based on electron-level information without quantum calculations ...

At first glance, quantum mechanics might seem strange or even impossible. That’s because our everyday experiences of the laws of physics are very different from how matter and energy behave at the ...

A new microchip-sized device could dramatically accelerate the future of quantum computing. It controls laser frequencies ...