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Hu Ting-He, Li Zhi-Hao, Zhang Qian-Fan.First principles and molecular dynamics simulations of effect of dopants on properties of high strength steel for hydrogen storage vessels. Acta Physica Sinica, 2024, 73(6): 067101.doi:10.7498/aps.73.20231735 |
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Dong Xiao.Density functional theory on reaction mechanism between p-doped LiNH2clusters and LiH and a new hydrogen storage and desorption mechanism. Acta Physica Sinica, 2023, 72(15): 153101.doi:10.7498/aps.72.20230374 |
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Zhang Feng, Lian Sen, Wang Ming-Yue, Chen Xue, Yin Ji-Kang, He Lei, Pan Hua-Qing, Ren Jun-Feng, Chen Mei-Na.Doping and strain effect on hydrogen evolution reaction catalysts of NiP2. Acta Physica Sinica, 2021, 70(14): 148802.doi:10.7498/aps.70.20210298 |
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Wang Li-Min, Liu Ri-Ping, Tian Yong-Jun.On glass formation thermodynamics: Enthalpy vs. Entropy. Acta Physica Sinica, 2020, 69(19): 196401.doi:10.7498/aps.69.20200707 |
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Cai Meng-Yuan, Tang Chun-Mei, Zhang Qiu-Yue.Optimized Li storage performance of B, N doped graphyne as Li-ion battery anode materials. Acta Physica Sinica, 2019, 68(21): 213601.doi:10.7498/aps.68.20191161 |
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Zhao Yu-Na, Gao Tao, Lü Jin-Zhong, Ma Jun-Gang.Thermodynamic properties of Li-N-H hydrogen storage: first-principles study. Acta Physica Sinica, 2013, 62(14): 143101.doi:10.7498/aps.62.143101 |
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Lu Jin-Lian, Cao Jue-Xian.A first-principles study of capacity and mechanism of a single titanium atom storing hydrogen. Acta Physica Sinica, 2012, 61(14): 148801.doi:10.7498/aps.61.148801 |
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Zhang Hui, Zhang Guo-Ying, Xiao Ming-Zhu, Lu Guang-Xia, Zhu Sheng-Long, Zhang Ke.First-principles study on influence of alloying element substitution on dehydrogenation ability of Li4BN3H10 hydrogen storage materials. Acta Physica Sinica, 2011, 60(4): 047109.doi:10.7498/aps.60.047109 |
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Tang Xin, Zhang Qing-Yu, Lü Hai-Feng, Pu Chun-Ying.First-principles study on the electronic structures and structural stability of Cd-doped ZnO. Acta Physica Sinica, 2011, 60(3): 037101.doi:10.7498/aps.60.037101 |
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Zhang Hui, Xiao Ming-Zhu, Zhang Guo-Ying, Lu Guang-Xia, Zhu Sheng-Long.Interpretation of dehydrogenation ability of high-density hydrogen storage materials by density functional theory. Acta Physica Sinica, 2011, 60(2): 026103.doi:10.7498/aps.60.026103 |
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Deng Yong-He, Liu Jing-Shuo.Formation abilities and electronic properties of Mg-TM-H (TM = Sc, Ti, V, Y, Zr, Nb) crystal. Acta Physica Sinica, 2011, 60(11): 117102.doi:10.7498/aps.60.117102 |
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Lu Guang-Xia, Zhang Hui, Zhang Guo-Ying, Liang Ting, Li Dan, Zhu Sheng-Long.Mechanism of the influence of the interaction between interstitial H atom and doped atom on the dehydrogenation performance of LiNH2. Acta Physica Sinica, 2011, 60(11): 117101.doi:10.7498/aps.60.117101 |
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Ren Guo-Hao, Chen Xiao-Feng, Mao Ri-Hua, Shen Ding-Zhong.Luminescence characteristics of lead tungstate (PbWO4) scintillation crystal doped with fluorine anions. Acta Physica Sinica, 2010, 59(7): 4812-4817.doi:10.7498/aps.59.4812 |
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Zhang Hui, Qi Ke-Zhen, Zhang Guo-Ying, Wu Di, Zhu Sheng-Long.First-principles study on the influence of component element substitution on the dehydrogenation ability of LiNH2 hydrogen storage materials. Acta Physica Sinica, 2009, 58(11): 8077-8082.doi:10.7498/aps.58.8077 |
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Zhou Jing-Jing, Chen Yun-Gui, Wu Chao-Ling, Pang Li-Juan, Zheng Xin, Gao Tao.The first-principles study on the elasticity of V-based solid solution hydrogen storage materials. Acta Physica Sinica, 2009, 58(10): 7044-7049.doi:10.7498/aps.58.7044 |
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Zhou Jing-Jing, Chen Yun-Gui, Wu Chao-Ling, Zheng Xin, Fang Yu-Chao, Gao Tao.First-pricinples design on atomic scale for new lightweight hydrogen storage materials. Acta Physica Sinica, 2009, 58(7): 4853-4861.doi:10.7498/aps.58.4853 |
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Chen Yu-Hong, Kang Long, Zhang Cai-Rong, Luo Yong-Chun, Pu Zhong-Sheng.Density functional theory study of the structures and properties of (Li3N)n(n=1—5) clusters. Acta Physica Sinica, 2008, 57(7): 4174-4181.doi:10.7498/aps.57.4174 |
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Chen Yu-Hong, Kang Long, Zhang Cai-Rong, Luo Yong-Chun, Ma Jun.Density functional theory study of ［Mg(NH2)2］n(n=1—5) clusters. Acta Physica Sinica, 2008, 57(8): 4866-4874.doi:10.7498/aps.57.4866 |
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Zhao Tai-Ze, Wang Fei, Guo Shao-Feng, Guo Wen-Kang, Xu Ping.Rapid enthalpy probe. Acta Physica Sinica, 2007, 56(10): 5952-5957.doi:10.7498/aps.56.5952 |
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Cheng Shan-Hua, Ning Zhao-Yuan, Huang Feng.. Acta Physica Sinica, 2002, 51(3): 668-673.doi:10.7498/aps.51.668 |
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