SO-QFT simulation of 2D hydrogenic electron. (A) Real projections of the ground ψ0,0 state (left) and a first excited ψ1,1 state (right) of 2D hydrogen. Note that the plots here do not reflect the ...

The CP2K open-source package is among the top three most widely used research software suites worldwide for simulating the ...

Microsoft has released open-source Quantum Development Kit tools for chemistry and error correction, with VS Code integration ...

Researchers at Chalmers University in Sweden have used a quantum computer to simulate a chemical reaction. Quantum chemistry is often modelled using supercomputers, which apply the laws of quantum ...

Rapid advances in applying artificial intelligence to simulations in physics and chemistry have some people questioning whether we will even need quantum computers at all. Tech companies have been ...

SandboxAQ has announced the acquisition of Good Chemistry, a prominent computational chemistry firm that uses quantum computing, artificial intelligence (AI), and other cutting-edge technologies to ...

Monoclonal antibodies (mAbs) aid the body against autoimmune diseases and cancer, among other things. Patients have to pick ...

In the reaction, the bonds in the methane and oxygen molecule come apart, the atoms rearrange and then re-bond to form water and carbon dioxide. The little number written at the lower right after an ...

Carbon dioxide reacts with water to produce carbonic acid. The double arrow means that carbonic acid breaks down pretty readily to form carbon dioxide and water again. A hydrogen atom from the ...