Honghui Shang
Titolo
Citata da
Citata da
Anno
Evidence for photogenerated intermediate hole polarons in ZnO
H Sezen, H Shang, F Bebensee, C Yang, M Buchholz, A Nefedov, ...
Nature communications 6 (1), 1-5, 2015
412015
Ultrafast multiphoton pump-probe photoemission excitation pathways in rutile TiO 2 (110)
A Argondizzo, X Cui, C Wang, H Sun, H Shang, J Zhao, H Petek
Physical Review B 91 (15), 155429, 2015
332015
Lattice dynamics calculations based on density-functional perturbation theory in real space
H Shang, C Carbogno, P Rinke, M Scheffler
Computer Physics Communications 215, 26-46, 2017
232017
Linear scaling electronic structure calculations with numerical atomic basis set
H Shang, H Xiang, Z Li, J Yang
International Reviews in Physical Chemistry 29 (4), 665-691, 2010
232010
HONPAS: A linear scaling open‐source solution for large system simulations
X Qin, H Shang, H Xiang, Z Li, J Yang
International Journal of Quantum Chemistry 115 (10), 647-655, 2015
182015
Implementation of exact exchange with numerical atomic orbitals
H Shang, Z Li, J Yang
The Journal of Physical Chemistry A 114 (2), 1039-1043, 2010
182010
Implementation of screened hybrid density functional for periodic systems with numerical atomic orbitals: Basis function fitting and integral screening
H Shang, Z Li, J Yang
The Journal of chemical physics 135 (3), 034110, 2011
162011
All-electron, real-space perturbation theory for homogeneous electric fields: theory, implementation, and application within DFT
H Shang, N Raimbault, P Rinke, M Scheffler, M Rossi, C Carbogno
New Journal of Physics 20 (7), 073040, 2018
92018
Li/MgO Catalysts Doped with Alio‐valent Ions. Part II: Local Topology Unraveled by EPR/NMR and DFT Modeling
U Simon, S Alarcn Villaseca, H Shang, SV Levchenko, S Arndt, ...
ChemCatChem 9 (18), 3597-3610, 2017
92017
The Moving-Grid Effect in the Harmonic Vibrational Frequency Calculations with Numeric Atom-Centered Orbitals
H Shang, J Yang
The Journal of Physical Chemistry A 124 (14), 2897-2906, 2020
12020
OpenKMC: a KMC design for hundred-billion-atom simulation using millions of cores on Sunway Taihulight
K Li, H Shang, Y Zhang, S Li, B Wu, D Wang, L Zhang, F Li, D Chen, ...
Proceedings of the International Conference for High Performance Computing…, 2019
12019
Efficient parallel linear scaling method to get the response density matrix in all-electron real-space density-functional perturbation theory
H Shang, WZ Liang, Y Zhang, J Yang
Computer Physics Communications 258, 107613, 2020
2020
The influence of high-energy local orbitals and electron-phonon interactions on the band gaps and optical spectra of hexagonal boron nitride
T Shen, XW Zhang, H Shang, MY Zhang, X Wang, EG Wang, H Jiang, ...
arXiv preprint arXiv:2003.12704, 2020
2020
The static parallel distribution algorithms for hybrid density-functional calculations in HONPAS package
X Qin, H Shang, L Xu, W Hu, J Yang, S Li, Y Zhang
The International Journal of High Performance Computing Applications 34 (2…, 2020
2020
The dynamic parallel distribution algorithm for hybrid density-functional calculations in HONPAS package
H Shang, L Xu, B Wu, X Qin, Y Zhang, J Yang
Computer Physics Communications, 107204, 2020
2020
Implementation of Laplace transformed MP2 for Periodic Systems with Numerical Atomic Orbitals
H Shang, J Yang
Frontiers in Chemistry 8, 956, 2020
2020
Electron-phonon coupling in -electron solids: A temperature-dependent study of rutile by first-principles theory and two-photon photoemission
H Shang, A Argondizzo, S Tan, J Zhao, P Rinke, C Carbogno, M Scheffler, ...
Physical Review Research 1 (3), 033153, 2019
2019
All-electron, real-space perturbation theory for homogeneous electric fields
H Shang, N Raimbault, P Rinke, M Scheffler, M Rossi, C Carbogno
2018
The moving-grid effect in density functional calculations of harmonic vibration frequencies using numeric atom-centered grids
H Shang
arXiv preprint arXiv:1801.00166, 2017
2017
Multi-photon Photoemission Dynamics in TiO2
A Argondizzo, X Cui, C Wang, H Sun, H Shang, J Zhao, H Petek
APS 2016, L32. 005, 2016
2016
Il sistema al momento non pu eseguire l'operazione. Riprova pi tardi.
Articoli 1–20