Работы, на которые ссылается эта работа

Работ: 81

Работа: Transition metal-functionalized hexagonal bipyramidal boron clusters as high-performance electrocatalysts for hydrogen evolution reaction: A DFT study

Effect of the damping function in dispersion corrected density functional theory
Stefan Grimme, Stephan Ehrlich, Lars Goerigk
Статья2011Цитирований: 25
ABI
Toward reliable density functional methods without adjustable parameters: The PBE0 model
Carlo Adamo, Vincenzo Barone
Статья1999Цитирований: 15
ABI
H2 production from coal by enriching sugar fermentation and alkane oxidation with hyperthermophilic resistance microbes in municipal wastewater
Huaiwen Zhang, Yaojing Qiu, Tairan Liu +7
Статья2024Цитирований: 14
ABI
Effects of hydrogen addition on ignition characteristics and engine performance of ammonia-hydrogen blended fuel: A kinetic analysis
Zhiqing Yu, Jianhui Zhao, В. А. Марков +1
Статья2024Цитирований: 13
ABI
Nitrogen-doped carbon trapped MnMoO4 microrods toward high performance aqueous zinc-ion battery
Lin Gao, Yanan Ma, Chuankun Zhang +1
Статья2023Цитирований: 5
ABI
Meta-transfer learning-based method for multi-fault analysis and assessment in power system
Lingfeng Zheng, Yuhong Zhu, Yongzhi Zhou
Статья2024Цитирований: 4
ABI
Enhancing prediction of electron affinity and ionization energy in liquid organic electrolytes for lithium-ion batteries using machine learning
Yuxin Zhan, Xiaojie Ren, Shuai Zhao +1
Статья2024Цитирований: 4
ABI
Mn incorporated BiOCl anode for high performance sodium ion batteries
Jie Xia, Lin Gao, Minglei Cao +5
Статья2025Цитирований: 4
ABI
Numerical study of proton exchange membrane fuel cells with airfoil cross flow field
Tiancai Cheng, Qiang Liu, Guang‐Jun Jiang +3
Статья2025Цитирований: 4
ABI
Gallium regulated MnO2 toward high performance Zn ion batteries
Lin Gao, Hao Hu, Chuankun Zhang +1
Статья2023Цитирований: 4
ABI
Cost‐Effective High Entropy Core–Shell Fiber for Stable Oxygen Evolution Reaction at 2 A cm<sup>−2</sup>
Yi‐Fan Cui, Si‐Da Jiang, Qiang Fu +9
Статья2023Цитирований: 3
ABI
Theoretical investigation of HER/OER/ORR catalytic activity of single atom-decorated graphyne by DFT and comparative DOS analyses
Mingming Guo, Mingjuan Ji, Wei Cui
Статья2022Цитирований: 3
ABI
Tailoring Si12C12 nanocluster with late first-row transition metals: A promising approach during single-atom catalysis toward hydrogen evolution reaction (HER)
Naveen Kosar, Saira Rafiq, Khurshid Ayub +2
Статья2024Цитирований: 3
ABI
Understanding the atomistic origin of the magnetic phases in Cobalt-TM (V, Nb, Ta, Zr, Hf, W) pair co-doped boron nitride monolayer and the hydrogenation effect
Debashis Roy, Md. Kamal Hossain, Syed Mahedi Hasan +3
Статья2020Цитирований: 3
ABI
Density Functional Theory for Electrocatalysis
Xiaobin Liao, Ruihu Lu, Lixue Xia +5
Статья2021Цитирований: 3
ABI
Transition metal loaded carbon penta-belt SACs for hydrogen and oxygen evolution reactions and identification of systematic DFT method to characterize the main interacting orbital for non-periodic system
Abdulrahman Allangawi, Khurshid Ayub, Mazhar Amjad Gilani +2
Статья2023Цитирований: 2
ABI
Single Atoms and Clusters Based Nanomaterials for Hydrogen Evolution, Oxygen Evolution Reactions, and Full Water Splitting
Siraj Sultan, Jitendra N. Tiwari, Aditya Narayan Singh +5
Статья2019Цитирований: 2
ABI
High performance SACs for HER process using late first-row transition metals anchored on graphyne support: A DFT insight
Faizan Ullah, Khurshid Ayub, Tariq Mahmood
Статья2021Цитирований: 2
ABI
First row transition metal doped B12P12 and Al12P12 nanocages as excellent single atom catalysts for the hydrogen evolution reaction
Abdulrahman Allangawi, Mazhar Amjad Gilani, Khurshid Ayub +1
Статья2023Цитирований: 2
ABI
CdN4C0-gra as efficient trifunctional electrocatalyst for the HER, OER and ORR: A density functional theory study
Luya Jin, Chao Liu, Daomiao Wang +4
Статья2022Цитирований: 2
ABI
Pristine fullerene (C24) metals (Mo, Fe, Au) engineered nanostructured materials as an efficient electro-catalyst for hydrogen evolution reaction (HER): A density functional theory (DFT) study
Ernest C. Agwamba, Hitler Louis, Bartholomew B. Isang +3
Статья2023Цитирований: 2
ABI
Electrocatalytic performance of transition metal mono-carbides (TM: CrC, FeC, MnC, TiC, VC) decorated on palladium-encapsulated fullerenes (TM-Pd@C60) for hydrogen evolution reaction (HER): A DFT perspective
Emmanuel Emmanuel, Ali Basem, Muna S. Merza +4
Статья2024Цитирований: 2
ABI
Probing the catalytic activity of first-row transition metal doped C20 fullerene as remarkable HER electrocatalysts: A DFT study
Sehrish Sarfaraz, Muhammad Yar, Ahmed Lakhani +3
Статья2023Цитирований: 2
ABI
First-principles investigations of metal (V, Nb, Ta)-doped monolayer MoS2: Structural stability, electronic properties and adsorption of gas molecules
Jia Zhu, Hui Zhang, Yawen Tong +4
Статья2017Цитирований: 2
ABI
Ruthenium decorated single walled carbon nanotube for molecular hydrogen storage: A first-principle study
Valeria Verdinelli, A. Juan, E. D. German
Статья2019Цитирований: 2
ABI