Theoretical calculations in Nature

From the top of the 10 Nature series, see how theoretical calculations show great power!

catalytic research

How does theoretical calculations assist in catalytic research?

battery material

Theoretical calculations in 10 major applications and 100+ cases in battery material research!

computing simulation in Science

More than 30 years of Science in 3 years, what can computing simulation do?

Robust microscale superlubricity in graphite/hexagonal boron nitride layered heterojunctions

Here we report the experimental realization of robust superlubricity in microscale monocrystalline heterojunctions, which constitutes an important step towards the macroscopic scale-up of superlubrici...

Graphene‐Based Fibers: Recent Advances in Preparation and Application

What is 2D material?

Two-dimensional nanomaterial ultracapacitor parts

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Thickness-independent capacitance of vertically aligned liquid-crystalline MXenes

Here we demonstrate electrochemical energy storage that is independent of film thickness for vertically aligned two-dimensional titanium carbide (Ti3C2T x ), a material from the MXene family