Publications
1 H. Xiao, R.
Li, X. Shi, Y. Chen, L. Zhu, L. Wang and X. Chen, An
invertible, invariant crystallographic representation for inverse design of
solid-state materials using generative deep learning,
DOI:10.26434/chemrxiv-2023-h4426.
2 X.
Shi, H. Xiao, W. Liu, Klaus. S. Lackner, V. Buterin
and T. F. Stocker, Confronting the Carbon-Footprint Challenge of Blockchain, Environ.
Sci. Technol., 2023, 57, 1403�C1410.
3 Z.
Xiong, H. Xiao and X. Chen, Fractal-inspired soft deployable structure:
a theoretical study, Soft Matter, 2021, 17, 4834�C4841.
4 Y.
Han, L. Zhu, Y. Yao, X. Shi, Y. Zhang, H. Xiao and X. Chen, Strong bases
behave as weak bases in nanoscale chemical environments: implication in
humidity-swing CO2 air capture, Phys. Chem. Chem. Phys., 2021, 23,
14811�C14817.
5 L.
Zhu, W. Zhao, Y. Yan, X. Liao, A. Bourtsalas, Y. Dan,
H. Xiao and X. Chen, Interaction between mechanosensitive channels
embedded in lipid membrane, J. Mech. Behav.
Biomed. Mater., 2020, 103, 103543.
6 Y.
Zheng, X. Liao, H. Xiao, V. Haribal, X. Shi,
Z. Huang, L. Zhu, K. Li, F. Li, H. Wang and X. Chen, Highly
efficient reduction of O2-containing CO2 via chemical looping based on
perovskite nanocomposites, Nano Energy, 2020, 78, 105320.
7 H.
Xiao, Y. Dan, B. Suo and X. Chen, Comment on ��Accelerated Discovery of New
8-Electron Half-Heusler Compounds as Promising Energy and Topological Quantum
Materials,�� J. Phys. Chem. C, 2020, 124, 2247�C2249.
8 J.
A. Mills, H. Xiao and X. Chen, Examination of Prestressed
Coating/Substrate Systems Using Spherical Indentation��Determination of Film
Prestress, Film Modulus, and Substrate Modulus, J. Eng. Mater. Technol.,
2020, 142, 011003.
9 D.
Ju, G. Lin, H. Xiao, Y. Zhang, S. Su and J.
Liu, Investigation of Water-Stable Perovskite DMASnIxBr3- x for Photoenzyme Catalysis in Aqueous Solution, Sol. RRL,
2020, 2000559.
10 J.
Song, L. Zhu, X. Shi, Y. Liu, H. Xiao and X. Chen, Moisture Swing
Ion-Exchange Resin-PO4 Sorbent for Reversible CO2 Capture from Ambient Air, Energy
Fuels, 2019, 33, 6562�C6567.
11 X.
Liao, X. Deng, L. Zhu, X. Shi, H. Xiao and X. Chen, Mechanical modeling
of pimple growth, J. Mech. Behav. Biomed. Mater.,
2019, 95, 191�C195.
12 Y.
Chen, X. Wang, Y. Liu, H. Xiao and X. Chen, Effect of Local Terrace on
Structure and Mechanics of Graphene Grain Boundary, J. Phys. Chem. C,
2019, 123, 28460�C28468.
13 Y.
Chen, X. Liao, X. Shi, H. Xiao, Y. Liu and X. Chen, Three-dimensional
auxetic properties in group V�CVI binary monolayer crystals X 3 M 2 (X = S, Se;
M = N, P, As), Phys. Chem. Chem. Phys., 2019, 21, 5916�C5924.
14 H.
Xiao, X. Shi, Y. Zhang, M. Li, X. Liao and X. Chen, Predicting a
two-dimensional P2S3 monolayer: A global minimum structure, Comput.
Mater. Sci., 2018, 155, 288�C292.
15 H.
Xiao, X. Shi, X. Liao, Y. Zhang and X. Chen, Prediction of a
two-dimensional S3N2 solid for optoelectronic applications, Phys. Rev.
Mater., 2018, 2, 024002.
16 X.
Liao, T. Nagakura, Y. Chen, L. Zhu, X. Shi, A. Yonezu, X. Chen and H. Xiao, Tunable surface
morphology via patterned cavities in soft materials, Phys. Rev. E, 2018,
98, 063004.
17 X.
Liao, Y. Chen, T. Nagakura, L. Zhu, M. Li, X. Shi, A.
Yonezu, H. Xiao and X. Chen, Unconventional
localization prior to wrinkles and controllable surface patterns of
film/substrate bilayers through patterned cavities, Extreme Mech. Lett.,
2018, 25, 66�C70.
18 D.
Ju, X. Zheng, J. Liu, Y. Chen, J. Zhang, B. Cao, H. Xiao, O. F.
Mohammed, O. M. Bakr and X. Tao, Reversible Band Gap Narrowing of Sn-Based Hybrid
Perovskite Single Crystal with Excellent Phase Stability, Angew.
Chem. Int. Ed., 2018, 57, 14868�C14872.
19 D.
Ju, X. Jiang, H. Xiao, X. Chen, X. Hu and X. Tao, Narrow band gap and
high mobility of lead-free perovskite single crystal Sn-doped MA 3 Sb 2 I 9, J.
Mater. Chem. A, 2018, 6, 20753�C20759.
20 F.
Hao, X. Liao, M. Li, H. Xiao and X. Chen, Oxidation-induced negative
Poisson��s ratio of phosphorene, J. Phys. Condens.
Matter, 2018, 30, 315302.
21 Y.
Chen, X. Shi, M. Li, Y. Liu, H. Xiao and X. Chen, Strain and defect
engineering on phase transition of monolayer black phosphorene, Phys. Chem.
Chem. Phys., 2018, 20, 21832�C21843.
22 H.
Xiao, X. Shi, Y. Zhang, X. Liao, F. Hao, K. S. Lackner and X. Chen, The
catalytic effect of H 2 O on the hydrolysis of CO 3 2- in hydrated clusters and
its implication in the humidity driven CO 2 air capture, Phys. Chem. Chem.
Phys., 2017, 19, 27435�C27441.
23 H.
Xiao, X. Shi, F. Hao, X. Liao, Y. Zhang and X. Chen, Development of a
Transferable Reactive Force Field of P/H Systems: Application to the Chemical
and Mechanical Properties of Phosphorene, J. Phys. Chem. A, 2017, 121,
6135�C6149.
24 H.
Xiao, X. Shi and X. Chen, Self-assembled nanocapsules in water: a molecular
mechanistic study, Phys. Chem. Chem. Phys., 2017, 19,
20377�C20382.
25 H.
Xiao and X. Chen, A mechanical model of overnight hair curling, Eur.
Phys. J. E, 2015, 38, 1�C8.
26 H.
Xiao and X. Chen, Modeling and simulation of curled dry leaves, Soft
Matter, 2011, 7, 10794�C10802.