Computation CHANGE TOPIC

Computation and theory news, January 2022

A novel hybrid ferritin nanocage shows enhanced uptake of an iridium complex. leading to improved catalytic efficiency for alcohol production.

Researchers have developed a cost-competitive, low-pressure method for turning industrially processed lignin into high-performance plastics.

Researchers have used a new powerful and speedy X-ray crystallography technique to determine the structures of two metal-organic materials.

Researchers have shown that sound can be used to analyze the production of laser-induced graphene in real time to determine its form and quality.

algorithm can predict the location of nanosilica particles in a nanocomposite and will aid the design of better materials

Researchers have developed a new method for producing low-symmetry colloidal crystals, including one with no known natural equivalent.

Researchers have developed a platform that uses machine learning to program the transformation of 2D stretchable materials into specific 3D shapes.

Using computational models, researchers have found that catalysis appears to function due to the action and propagation of electron holes.

Paddlewheel-like molecular dynamics help to push sodium ions through a novel solid electrolyte being investigated for use in sodium-ion batteries.

A new open-source software tool can calculate the fundamental constants needed to describe the physical properties of crystalline solids.

By applying machine learning to the data in their own megalibraries, researchers have successfully guided the synthesis of new nanomaterials.

Researchers have developed a method to stabilize the zigzag edges of graphene nanoribbons and directly measure their magnetic properties.

Using 3D printing, researchers have created magnetic double helices that can produce nanoscale topological textures in the magnetic field.

New battery material offers useful stability and recharges as fast as lithium-ion batteries

Using a design known as a Z scheme, researchers have developed a new artificial photosynthesis device with remarkable stability and longevity.

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