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First-principles insights into hydrogen trapping in interstitial-vacancy complexes in vanadium carbide 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 34, 页码: 20400-20408
作者:  Tang, Shuai;  Li, Lin-xian;  Peng, Qing;  Yan, Hai-le;  Cai, Ming-hui
收藏  |  浏览/下载:41/0  |  提交时间:2022/09/16
Density functional theory research on the adsorption properties of Ti-doped graphene for acetone and other gases 期刊论文
Materials Science in Semiconductor Processing, 2022, 卷号: 138
作者:  Jiang, Lili;  Chen, Zhaoyu;  Cui, Qi;  Xu, Su;  Hou, Xingang
收藏  |  浏览/下载:23/0  |  提交时间:2022/02/17
Understanding charge storage in Nb2CTx MXene as an anode material for lithium ion batteries 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2021, 页码: 11
作者:  Cheng, Renfei;  Hu, Tao;  Wang, Zuohua;  Yang, Jinxing;  Dai, Ruqiao
收藏  |  浏览/下载:34/0  |  提交时间:2021/11/22
Structural and Electronic Properties of (HfH2)(n) (n=5-30) Clusters: Theoretical Investigation 期刊论文
PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES, 2021, 卷号: 128, 页码: 9
作者:  Soomro, Irfan Ali;  Lv, Na;  Lakhan, Muhammad Nazim;  Shar, Altaf Hussain;  Ahmed, Mukhtiar
收藏  |  浏览/下载:47/0  |  提交时间:2021/10/15
Structural and Electronic Properties of (HfH2)(n) (n=5-30) Clusters: Theoretical Investigation 期刊论文
PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES, 2021, 卷号: 128, 页码: 9
作者:  Soomro, Irfan Ali;  Lv, Na;  Lakhan, Muhammad Nazim;  Shar, Altaf Hussain;  Ahmed, Mukhtiar
收藏  |  浏览/下载:22/0  |  提交时间:2021/03/29
A thermodynamic and kinetic study of the catalytic performance of Fe, Mo, Rh and Ru for the electrochemical nitrogen reduction reaction 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2020, 卷号: 22, 期号: 44, 页码: 25973-25981
作者:  Shi, Jun-Lin;  Xiang, Shi-Qin;  Zhang, Wei;  Zhao, Liu-Bin
收藏  |  浏览/下载:14/0  |  提交时间:2021/02/24
Iron/nickel nano-alloy encapsulated in nitrogen-doped carbon framework for CO2 electrochemical conversion with prominent CO selectivity 期刊论文
JOURNAL OF POWER SOURCES, 2020, 卷号: 449, 页码: 8
作者:  Lu, Peilong;  Zhang, Jingxian;  He, Hongyan;  Wang, Meng;  Luo, Zhaopeng
收藏  |  浏览/下载:7/0  |  提交时间:2020/03/24
First-principles calculation of stability, electronic and optical properties of PCBM-adsorbed MAPbI3 surface 期刊论文
Materials Research Express, 2019, 卷号: 6, 期号: 11
作者:  Tian, Ying;  Xue, Hongtao;  Tang, Fuling;  Wang, Lifu;  Jiang, Haiyan
收藏  |  浏览/下载:0/0  |  提交时间:2020/11/14
First-principles calculation of stability, electronic and optical properties of PCBM-adsorbed MAPbI(3) surface 期刊论文
MATERIALS RESEARCH EXPRESS, 2019, 卷号: 6, 期号: 11
作者:  Tian, Ying;  Xue, Hongtao;  Tang, Fuling;  Wang, Lifu;  Jiang, Haiyan
收藏  |  浏览/下载:4/0  |  提交时间:2020/06/02
First-principles study on OH-functionalized 2D electrides: Ca2NOH and Y2C(OH)(2), promising two-dimensional monolayers for metal-ion batteries 期刊论文
Applied Surface Science, 2019, 卷号: 478, 页码: 459-464
作者:  D.D.Wang;  H.B.Li;  L.L.Zhang;  Z.H.Sun;  D.X.Han
收藏  |  浏览/下载:1/0  |  提交时间:2020/08/24


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