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Zhaoru Sun
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Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional
J Sun, RC Remsing, Y Zhang, Z Sun, A Ruzsinszky, H Peng, Z Yang, ...
Nature chemistry 8 (9), 831-836, 2016
8522016
Ab initio theory and modeling of water
M Chen, HY Ko, RC Remsing, MF Calegari Andrade, B Santra, Z Sun, ...
Proceedings of the National Academy of Sciences 114 (41), 10846-10851, 2017
3672017
Structural, electronic, and dynamical properties of liquid water by ab initio molecular dynamics based on SCAN functional within the canonical ensemble
L Zheng, M Chen, Z Sun, HY Ko, B Santra, P Dhuvad, X Wu
The Journal of Chemical Physics 148 (16), 2018
762018
Electron-hole theory of the effect of quantum nuclei on the X-ray absorption spectra of liquid water
Z Sun, L Zheng, M Chen, ML Klein, F Paesani, X Wu
Physical Review Letters 121 (13), 137401, 2018
492018
A route toward digital manipulation of water nanodroplets on surfaces
M Cheng, D Wang, Z Sun, J Zhao, R Yang, G Wang, W Yang, G Xie, ...
ACS nano 8 (4), 3955-3960, 2014
372014
Role of proton ordering in adsorption preference of polar molecule on ice surface
Z Sun, D Pan, L Xu, E Wang
Proceedings of the National Academy of Sciences 109 (33), 13177-13181, 2012
362012
Liquid-liquid phase transition in water
ZR Sun, G Sun, YX Chen, LM Xu
Science China Physics, Mechanics & Astronomy 57, 810-818, 2014
252014
Inorganic Low k Cage-molecular Crystals
J Peng, W Pu, S Lu, X Yang, C Wu, N Wu, Z Sun, HT Wang
Nano Letters 21 (1), 203-208, 2020
242020
The influence of surface chemistry on critical current density for garnet electrolyte
S Chen, Z Nie, F Tian, L Nie, R Wei, J Yu, T Gao, Z Sun, N Yang, W Liu
Advanced Functional Materials 32 (23), 2113318, 2022
232022
SCAN: An efficient density functional yielding accurate structures and energies of diversely-bonded materials
J Sun, RC Remsing, Y Zhang, Z Sun, A Ruzsinszky, H Peng, Z Yang, ...
arXiv preprint arXiv:1511.01089, 2015
232015
Moiré phonons in magic-angle twisted bilayer graphene
X Liu, R Peng, Z Sun, J Liu
Nano Letters 22 (19), 7791-7797, 2022
202022
X-ray absorption of liquid water by advanced ab initio methods
Z Sun, M Chen, L Zheng, J Wang, B Santra, H Shen, L Xu, W Kang, ...
Physical Review B 96 (10), 104202, 2017
192017
Importance of nuclear quantum effects on the hydration of chloride ion
J Xu, Z Sun, C Zhang, M DelloStritto, D Lu, ML Klein, X Wu
Physical Review Materials 5 (1), L012801, 2021
142021
On-surface synthesis of c144 hexagonal coronoid with zigzag edges
X Zhu, Y Liu, W Pu, FZ Liu, Z Xue, Z Sun, KK Yan, P Yu
ACS nano 16 (7), 10600-10607, 2022
122022
Elastic Properties of High-Symmetry Sb4O6 Cage-Molecular Crystal
C Wu, J Peng, W Pu, S Lu, C Zhang, N Wu, Z Sun, H Zhang, HT Wang
The Journal of Physical Chemistry Letters 12 (37), 9011-9019, 2021
42021
Molecular dynamics simulation of ammonium ion removal by freezing concentration
M Liu, Q Shi, Z Sun
Nano Express 3 (4), 045005, 2023
32023
Signature of the hydrogen-bonded environment of liquid water in X-ray emission spectra from first-principles calculations
H Shen, M Chen, Z Sun, L Xu, E Wang, X Wu
Frontiers of Physics 13, 1-10, 2018
32018
The Atomistic Understanding of the Ice Recrystallization Inhibition Activity of Antifreeze Glycoproteins
W Yang, Y Liao, Q Shi, Z Sun
Crystals 13 (3), 405, 2023
22023
Progress in the structural and physical properties of ice surface
Z Sun, D Pan, L Xu, E Wang
Scientia Sinica Physica, Mechanica & Astronomica 43 (10), 1144, 2013
22013
On-Surface Synthesis of All-cis Standing Phenanthrene Polymers upon Selective C–H Bond Activation
Q Du, W Pu, Z Sun, P Yu
The Journal of Physical Chemistry Letters 11 (13), 5022-5028, 2020
12020
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Articles 1–20