Concepedia

Heat transport exploration through the GaN/diamond interfaces using machine learning potential

Zhanpeng Sun, Yunfei Song, Zijun Qi, Xiang Sun, Meiyong Liao, Rui Li, Qijun Wang, Lijie Li, Gai Wu, Wei Shen,

International Journal of Heat and Mass Transfer · 2025 · 29 citations · 52 references

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52

From ultrasoft pseudopotentials to the projector augmented-wave method

Georg Kresse, Daniel P. Joubert · Physical review. B, Condensed matter · 1999 · 83.6K citations

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Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

Georg Kresse, J. Furthmüller · Computational Materials Science · 1996 · 74.7K citations

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<i>VESTA 3</i> for three-dimensional visualization of crystal, volumetric and morphology data

Koichi Momma, Fujio Izumi · Journal of Applied Crystallography · 2011 · 25.2K citations

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Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool

Alexander Stukowski · Modelling and Simulation in Materials Science and Engineering · 2009 · 16.1K citations

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VASPKIT: A user-friendly interface facilitating high-throughput computing and analysis using VASP code

Vei Wang, Nan Xu, Jincheng Liu et al. · Computer Physics Communications · 2021 · 7.3K citations · Full text

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