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Chinese Academy of Sciences Institutional Repositories Grid
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Computation screening for high-performance photocatalysts in normal spinels
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 82, 页码: 218-224
作者:
Liu, Dongyan
;
Lou, Wenbo
;
Li, Xuesi
;
Zhang, Depeng
;
Wang, Shengyan
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2025/04/27
Spinel
Photocatalytic
First-principles
AB 2 O 4
Computation screening for high-performance photocatalysts in normal spinels
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 82, 页码: 218-224
作者:
Liu, Dongyan
;
Lou, Wenbo
;
Li, Xuesi
;
Zhang, Depeng
;
Wang, Shengyan
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2025/04/27
Spinel
Photocatalytic
First-principles
AB 2 O 4
Computation screening for high-performance photocatalysts in normal spinels
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 82, 页码: 218-224
作者:
Liu, Dongyan
;
Lou, Wenbo
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2025/04/27
Spinel
Photocatalytic
First-principles
AB 2 O 4
Pressure-Induced Re-Entrant Superconductivity in Transition Metal Dichalcogenide TiSe
2
期刊论文
OAI收割
SMALL, 2024
作者:
Xia, Wei
;
Wu, Jiaxuan
;
Xia, Chengliang
;
Li, Zhongyang
;
Yuan, Jian
  |  
收藏
  |  
浏览/下载:58/0
  |  
提交时间:2024/11/22
ab initio calculations
high pressure
re-entrant superconductivity
structural transition
transition metal dichalcogenide
Four-component full relativistic study on the spectroscopic properties and direct laser cooling schemes for the PbH, PoH, BiH
+
, and AtH
+
molecules
期刊论文
OAI收割
JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER, 2024, 卷号: 321, 页码: 109001
作者:
Luan, Jing-Zhen
;
Yang, Chuan-Lu
;
Li, Xiao-Hu
;
Zhao, Wen-Kai
;
Liu, Yu-Liang
  |  
收藏
  |  
浏览/下载:32/0
  |  
提交时间:2024/07/02
Spin-orbit coupling
Relativistic
Frank-Condon factor
Laser cooling
ab initio calculation
Theoretical investigation on structure, mechanical performance and oxidation resistance of the boron-doped PyC interphase in SiCf/ SiC composites
期刊论文
OAI收割
JOURNAL OF THE EUROPEAN CERAMIC SOCIETY, 2024, 卷号: 44, 期号: 5, 页码: 3074-3083
作者:
Liu, Mei
;
Zhang, Siyan
;
Luo, Yixiu
;
Sun, Luchao
;
Wang, Jiemin
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2025/04/27
Ceramic matrix composites (CMCs)
Ab-initio molecular dynamics (AIMD)
Pyrolytic carbon (PyC)
Interphase
Machine Learning-Accelerated First-Principles Study of Atomic Configuration and Ionic Diffusion in Li
10
GeP
2
S
12
Solid Electrolyte
期刊论文
OAI收割
MATERIALS, 2024, 卷号: 17, 期号: 8, 页码: 14
作者:
Qi, Changlin
;
Zhou, Yuwei
;
Yuan XZ(袁晓泽)
;
Peng Q(彭庆)
;
Yang, Yong
  |  
收藏
  |  
浏览/下载:59/0
  |  
提交时间:2024/05/27
Li10GeP2S12 solid electrolyte
first-principles calculation
Ewald-summation-based electrostatic energy
machine learning- and active-learning-based LAsou method
ab initio molecular dynamics
First-principles design of high strength refractory high-entropy alloys
期刊论文
OAI收割
JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMR&T, 2024, 卷号: 29, 页码: 3420-3436
作者:
Liu, Pengjing
;
Zhang, Hualei
;
Hu, Qingmiao
;
Ding, Xiangdong
;
Sun, Jun
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2025/04/27
Multi -principal element alloys
Solid solution strengthening
Hardness and strength
Elastic properties
Anisotropy
Ab initio calculations
Function of cleavage strength for symmetrical tilt grain boundaries
期刊论文
OAI收割
ENGINEERING FRACTURE MECHANICS, 2024, 卷号: 295, 页码: 14
作者:
Hu SW(胡世威)
;
Liang, Hao
;
Yin, Yihui
;
Liang, Yanxiang
;
Zhang, Yuanzhang
  |  
收藏
  |  
浏览/下载:107/0
  |  
提交时间:2024/02/05
Cleavage strength
Grain boundaries
Theoretical model
Ab initio tensile simulation
Critical energy release rate
Characteristics of
Shisa
Family Genes in Zebrafish
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2023, 卷号: 24, 期号: 18, 页码: 17
作者:
Liu, Yansong
;
Du, Na
;
Qian, Beibei
;
Zou, Congcong
;
Yu, Zhouxin
  |  
收藏
  |  
浏览/下载:81/0
  |  
提交时间:2024/04/07
gene expression
knockdown
CRISPR/Cas13d
shisa-2
mesp-ab
somite formation