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Theoretical Studies of High-Pressure Phases, Electronic Structure, and Vibrational Properties of NaNH2 期刊论文
Journal of Physical Chemistry C, 2012, 卷号: 116, 期号: 15, 页码: 8387-8393
Authors:  Y. Zhong;  H. Y. Zhou;  C. H. Hu;  D. H. Wang;  A. R. Oganov
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Hydrogen-storage Material  Crystal-structure Prediction  System  Transition  Desorption  Dynamics  Hydrides  Spectra  Naalh4  Imides  
基于密度泛函理论解读不同高密度储氢材料释氢能力 期刊论文
物理学报, 2011, 期号: 2, 页码: 552-557
Authors:  张辉;  肖明珠;  张国英;  路广霞;  朱圣龙
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储氢材料  第一原理  释氢能力  
Effects of carbon on hydrogen storage performances of hydrides 期刊论文
Journal of Materials Chemistry, 2010, 卷号: 20, 期号: 26, 页码: 5390-5400
Authors:  C. Z. Wu;  H. M. Cheng
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Metal-organic Frameworks  Prepared Nanostructured Graphite  Ammonia  Borane Nanocomposites  Sodium Aluminum-hydride  N-h Compounds  Ab-initio  Thermal-decomposition  Magnesium Hydride  Mg(0001) Surface  Reversible Dehydrogenation  
Advanced Materials for Energy Storage 期刊论文
Advanced Materials, 2010, 卷号: 22, 期号: 8, 页码: E28-+
Authors:  C. Liu;  F. Li;  L. P. Ma;  H. M. Cheng
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Lithium-ion Batteries  Carbon Nanotube Electrodes  Enhanced Hydrogen  Storage  Metal-organic Frameworks  Double-layer Capacitors  N-h System  Carbide-derived Carbons  Ammonia Borane Dehydrogenation  Ordered  Mesoporous Carbons  High-rate Performance  
First Principles Study on Hydrogen Desorption from a Metal (=Al, Ti, Mn, Ni) Doped MgH(2) (110) Surface 期刊论文
Journal of Physical Chemistry C, 2010, 卷号: 114, 期号: 25, 页码: 11328-11334
Authors:  J. H. Dai;  Y. Song;  R. Yang
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Magnesium Hydride Mgh2  Ab-initio  Sorption Properties  Storage  Dehydrogenation  Diffraction  Kinetics  Titanium  Cr2o3  Fe  
Improved hydrogen storage properties of LiBH(4) by mechanical milling with various carbon additives 期刊论文
International Journal of Hydrogen Energy, 2010, 卷号: 35, 期号: 15, 页码: 8247-8252
Authors:  Z. Z. Fang;  X. D. Kang;  P. Wang
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Lithium Borohydride  Carbon Additive  Mechanical Milling  Hydrogen  Storage  Arc-discharge Method  Lithium Borohydride  Nanotubes  Performances  Composite  Hydrides  
A first principles study of the thermal stability of A(m)(MH(4))(n) light complex hydrides 期刊论文
Journal of Physics-Condensed Matter, 2010, 卷号: 22, 期号: 17
Authors:  Y. L. Wang;  S. Liu;  L. J. Rong;  Y. M. Wang
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Reversible Hydrogen Storage  Doped Naalh4  Mechanochemical Synthesis  Lithium Borohydride  Metal Hydrides  Ti  Transition  Libh4  Sc  1st-principles  
Influence of dopants Ti and Ni on bonding interactions and dehydrogenation properties of lithium alanate 期刊论文
Physical Chemistry Chemical Physics, 2010, 卷号: 12, 期号: 36, 页码: 10942-10949
Authors:  Y. Song;  J. H. Dai;  X. M. Liang;  R. Yang
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Reversible Hydrogen Storage  Aluminum-hydride  Thermal-decomposition  Electronic-structure  Lialh4  Naalh4  Transformations  1st-principles  Mechanisms  Desorption  
Improved hydrogen storage property of Li-Mg-B-H system by milling with titanium trifluoride 期刊论文
Energy & Environmental Science, 2009, 卷号: 2, 期号: 1, 页码: 120-123
Authors:  P. J. Wang;  L. P. Ma;  Z. Z. Fang;  X. D. Kang;  P. Wang
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Complex Hydrides  Libh4  Tif3  Kinetics  Naalh4  
Study of Hydrogen Storage Properties of Lithium Borohydride 期刊论文
Progress in Chemistry, 2009, 卷号: 21, 期号: 10, 页码: 2212-2218
Authors:  Z. Z. Fang;  X. D. Kang;  P. Wang
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Hydrogen Storage Materials  Lithium Borohydride  Nanostructure  Thermodynamics  Kinetics  Destabilized Metal-hydrides  Walled Carbon Nanotubes  Complex Hydrides  Reversible Dehydrogenation  Crystal-structure  Libh4  Release  1st-principles  Mixtures  Lib0.33n0.67h2.67