Congwei Xie

6PUBLICATIONS
11CO-AUTHORS
Nonlinear optics and spectroscopyMetal organic frameworksChemical and thermal processes in energy and combustionComposite and hybrid materials
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Publications (6)

|Aug 17, 2026
Impact of scissors-correction schemes on first-principles calculations of second-harmonic generation in ultraviolet nonlinear-optical crystals.

|May 07, 2026
Computational design of new DUV NLO fluorooxoborates with [BO3] : [BO3F] = 2 : 1 via an anionic framework dimensionality-fixed strategy.

|Sep 16, 2024
Ab Initio Kinetic Pathway of Diborane Decomposition on Transition Metal Surfaces in Borophene Chemical Vapor Deposition Growth.

Dan Sun, Xianqi Song, Linlin Liu

|Jul 08, 2024
A Machine-Learning-Assisted Crystalline Structure Prediction Framework To Accelerate Materials Discovery.

Ran An, Congwei Xie, Dongdong Chu

|Mar 17, 2023
Target-Driven Design of Deep-UV Nonlinear Optical Materials via Interpretable Machine Learning.

Mengfan Wu, Evgenii Tikhonov, Abudukadi Tudi

|Oct 24, 2022
PNO: a promising deep-UV nonlinear optical material with the largest second harmonic generation effect.

Congwei Xie, Abudukadi Tudi, Artem R Oganov

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Frequent Collaborators

3 joint publications

Shilie Pan

3 joint publications

Zhihua Yang

1 joint publications

Artem R Oganov

1 joint publications

Xianqi Song