中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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Superior properties of biochar contribute to soil carbon sequestration and climate change mitigation
期刊论文
OAI收割
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING, 2025, 卷号: 13, 期号: 3, 页码: 12
作者:
He, Debo
;
Yang, Rui
;
Fu, Yan
;
Zhu, Bo
  |  
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2025/07/21
Global climate change
Soil greenhouse gas emissions
CO2 emissions reduction
CH4 uptake
DFT calculation
Innovative Fluorinated Polyimides with Superior Thermal, Mechanical, and Dielectric Properties for Advanced Soft Electronics
期刊论文
OAI收割
POLYMERS, 2025, 卷号: 17, 期号: 3, 页码: 12
作者:
Chen YW(陈钰玮)
;
Liu YD(刘屹东)
;
Min, Yonggang
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2025/03/21
fluorinated
polyimide
low dielectric constant
molecular dynamics
DFT
A fast test compaction method using dedicated Pure MaxSAT solver embedded in DFT flow
期刊论文
OAI收割
INTEGRATION-THE VLSI JOURNAL, 2025, 卷号: 100, 页码: 11
作者:
Chao, Zhiteng
;
Zhang, Xindi
;
Huang, Junying
;
Liu, Zizhen
;
Zhao, Yixuan
  |  
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2024/12/06
Static test compaction
Pure MaxSAT
DFT
ATPG
Evaluation of tetracycline photocatalytic degradation using NiFe
2
O
4
/CeO
2
/GO nanocomposite for environmental remediation: In silico molecular docking, antibacterial performance, degradation pathways, and DFT calculations
期刊论文
OAI收割
SEPARATION AND PURIFICATION TECHNOLOGY, 2024, 卷号: 351
作者:
Latif, Misbah
;
Nawaz, Raziq
;
Aziz, Muhammad Hammad
;
Asif, Muhammad
;
Noor, Fatima
  |  
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2024/11/20
Graphene Oxide
Tetracycline hydrochloride (TC-HCl)
Photocatalyst
Density Functional Theory (DFT)
Photocatalysis
Antibacterial activity
Magnetic splitting induced ferromagnetism in chromium-doped HfSe
2
期刊论文
OAI收割
CHINESE JOURNAL OF PHYSICS, 2024, 卷号: 92
作者:
Ali, Hamid
;
Iqbal, Obaid
;
Alarfaji, Saleh S.
;
Liu, Fengguang
;
Hong, Bin
  |  
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2024/11/20
Magnetic splitting
Ferromagnetism
ARPES
DFT
Germacrane-type sesquiterpenes from Artemisia atrovirens and their anti-inflammatory activity
期刊论文
OAI收割
FITOTERAPIA, 2024, 卷号: 179, 页码: 11
作者:
Tang, Chunping
;
Zheng, Yongzhe
;
Shao, Zhengguang
;
Ke, Chang-Qiang
;
Feng, Zheling
  |  
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2024/11/26
Artemisia atrovirens
Atrovirenolides C -I
Atrovirenoic acid G
Diatrovirenolides A -B
DFT NMR calculation
TDDFT ECD calculation
Machine learning models and computational simulation techniques for prediction of anti-corrosion properties of novel benzimidazole derivatives
期刊论文
OAI收割
MATERIALS TODAY COMMUNICATIONS, 2024, 卷号: 41, 页码: 23
作者:
Ekeocha, Christopher Ikechukwu
;
Uzochukwu, Ikechukwu Nelson
;
Etim, Ini-Ibehe Nabuk
;
Onyeachu, Benedict Ikenna
;
Oguzie, Emeka Emmanuel
  |  
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2024/12/20
Corrosion inhibitors
DFT
MD simulation
predictive model
machine learning
First-principles study of hydrogen trapping and diffusion mechanisms in vanadium carbide with connecting carbon vacancies
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 91, 页码: 611-617
作者:
Li, Linxian
;
Lan, Huifang
;
Tang, Shuai
;
Yan, Haile
;
Tan, Fengliang
  |  
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2024/11/22
DFT calculation
VC precipitates
Hydrogen trap
Hydrogen diffusion
Aplospojaveedins A-C, unusual sulfur-containing alkaloids produced by the endophytic fungus
Aplosporella javeedii
using OSMAC strategy
期刊论文
OAI收割
FRONTIERS IN MICROBIOLOGY, 2024, 卷号: 15, 页码: 10
作者:
Gao, Ying
;
Frank, Marian
;
Teusch, Nicole
;
Woschko, Dennis
;
Janiak, Christoph
  |  
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2024/12/20
Aplosporella javeedii
alkaloids
OSMAC approach
X-ray diffraction
DFT-NMR calculations
TDDFT-ECD calculations
target prediction
Theoretical study of novel antipyrine derivatives as promising corrosion inhibitors for mild steel in an acidic environment
期刊论文
OAI收割
STRUCTURAL CHEMISTRY, 2024, 页码: 17
作者:
Ekeocha, Christopher Ikechukwu
;
Uzochukwu, Ikechukwu Nelson
;
Onyeachu, Ikenna Benedict
;
Etim, Ini-Ibehe Nabuk
;
Oguzie, Emeka Emmanuel
  |  
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2024/12/20
Acid cleaning
Antipyrine derivatives
Corrosion inhibitors
DFT
MD simulation
Mild steel