Nanostructured materials for solid-state hydrogen storage: A review of the achievement of COST Action MP1103

International Journal of Hydrogen Energy

Volumn 41, Issue 32, 2016, Pages 14404-14428

  Callini, Elsa ^a,t   Aguey Zinsou, Kondo Francois ^b   Ahuja, Rajeev ^c,d   Ares, Josè Ramon ^e   Bals, Sara ^f   Biliškov, Nikola ^g   Chakraborty, Sudip ^c   Charalambopoulou, Georgia ^h   Chaudhary, Anna Lisa ⁱ   Cuevas, Fermin ^j   Dam, Bernard ^k   de Jongh, Petra ^l   Dornheim, Martin ⁱ   Filinchuk, Yaroslav ^m   Grbović Novaković, Jasmina ⁿ   Hirscher, Michael ^o   Jensen, Torben R ^p   Jensen, Peter Bjerre ^q   Novaković, Nikola ⁿ   Lai, Qiwen ^b   Leardini, Fabrice ^e   Gattia, Daniele Mirabile ^r   Pasquini, Luca ^s   Steriotis, Theodore ^h   Turner, Stuart ^f   Vegge, Tejs ^q   Züttel, Andreas ^a,t   Montone, Amelia ^r   more..

^a EPFL   (Switzerland)

^b UNIVERSITY OF NEW SOUTH WALES   (Australia)

^c UPPSALA UNIVERSITY   (Sweden)

^d ROYAL INSTITUTE OF TECHNOLOGY   (Sweden)

^e UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^f UNIVERSITY OF ANTWERP   (Belgium)

^g RUDER BO KOVI INSTITUTE   (Croatia)

^h INSTITUTE OF NANOSCIENCE AND NANOTECHNOLOGY   (Greece)

ⁱ INSTITUTE OF MATERIALS RESEARCH   (Germany)

^j CNRS   (France)

^k DELFT UNIVERSITY OF TECHNOLOGY   (Netherlands)

^l UTRECHT UNIVERSITY   (Netherlands)

^m UNIVERSITÉ CATHOLIQUE DE LOUVAIN   (Belgium)

ⁿ UNIVERSITY OF BELGRADE   (Serbia)

^o MAX PLANCK INSTITUTE FOR INTELLIGENT SYSTEMS   (Germany)

^p AARHUS UNIVERSITY   (Denmark)

^q TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

^r ENEA   (Italy)

^s UNIVERSITY OF BOLOGNA   (Italy)

^t SWISS FEDERAL LABORATORIES FOR MATERIALS SCIENCE AND TECHNOLOGY   (Switzerland)

more..

Author keywords

Hydrogen storage; Modeling; Nanostructure; Novel materials

Indexed keywords

COMPLEX NETWORKS; HYDRIDES; HYDROGEN; HYDROGENATION; INTERNATIONAL COOPERATION; METAL HALIDES; MODELS; NANOCOMPOSITE FILMS; NANOSTRUCTURED MATERIALS; NANOSTRUCTURES; STORAGE (MATERIALS);

EUROPEAN RESEARCH AREA; HYDROGENATION REACTIONS; INTERDISCIPLINARY RESEARCH; NOVEL MATERIALS; SCIENCE AND TECHNOLOGY; SOLID-STATE HYDROGEN STORAGE; TECHNOLOGICAL APPLICATIONS; THREE DIMENSIONAL SYSTEMS;

HYDROGEN STORAGE;

EID: 84975132423     PISSN: 03603199     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ijhydene.2016.04.025     Document Type: Review

References (194)

1. [1] Schlapbach, L., Züttel, A., Hydrogen-storage materials for mobile applications. Nature 414 (2001), 353–358.
2. [2] US. DOE. EERE, Fuel Cell Technologies Program Multi-Year Research, Development and Demonstration Plan, Section 3.3.
3. [3] Jepsen, Lars, Ley, Morten B., Young, Su-Lee, Cho, Young Whan, Dornheim, Martin, Jensen, Jens Oluf, et al. Boron-nitrogen based hydrides and reactive composites for hydrogen storage. Mater Today 17:3 (2014), 129–135.
4. [4] Ley, Morten B., Jepsen, Lars H., Lee, Young-Su, Cho, Young Whan, von Colbe, José Bellosta, Dornheim, Martin, et al. Complex hydrides for hydrogen storage – new perspectives. Mater Today 17:3 (2014), 122–128.
5. [5] Cramer, C.J., Truhlar, D.G., Density functional theory for transition metals and transition metal chemistry. Phys Chem Chem Phys 11 (2009), 10757–10816, 10.1039/b907148b.
6. [6] Cohen, A.J., Mori-Sánchez, P., Yang, W., Challenges for density functional theory. Chem Rev 112 (2012), 289–320, 10.1021/cr200107z.
7. [7] Burke, K., Perspective on density functional theory. J Chem Phys, 136, 2012, 150901, 10.1063/1.4704546.
8. [8] Curtarolo, S., Hart, G.L.W., Nardelli, M.B., Mingo, N., Sanvito, S., Levy, O., The high-throughput highway to computational materials design. Nat Mater 12 (2013), 191–201, 10.1038/nmat3568.
9. [9] Neugebauer, J., Hickel, T., Density functional theory in materials science. Wiley Interdiscip Rev Comput Mol Sci 3 (2013), 438–448, 10.1002/wcms.1125.
10. [10] Lejaeghere, K., Van Speybroeck, V., Van Oost, G., Cottenier, S., Error estimates for solid-state density-functional theory predictions: an overview by means of the ground-state elemental crystals. Crit Rev Solid State Mater Sci 39 (2014), 1–24, 10.1080/10408436.2013.772503.
11. [11] Hohenberg, P., Kohn, W., Inhomogeneous electron gas. Phys Rev 136 (1964), B864–B871, 10.1103/PhysRev.136.B864.
12. [12] Kohn, W., Sham, L.J., Self-consistent equations including exchange and correlation effects. Phys Rev 140 (1965), A1133–A1138, 10.1103/PhysRev.140.A1133.
13. [13] Shi, Q., Voss, J., Jacobsen, H.S., Lefmann, K., Zamponi, M., Vegge, T., Point defect dynamics in sodium aluminum hydrides—A combined quasielastic neutron scattering and density functional theory study. J Alloys Compd 446–447 (2007), 469–473, 10.1016/j.jallcom.2007.04.041.
14. [14] Hummelshøj, J.S., Landis, D.D., Voss, J., Jiang, T., Tekin, A., Bork, N., et al. Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project. J Chem Phys, 131, 2009, 014101, 10.1063/1.3148892.
15. [15] Huot, J., Ravnsbæk, D.B., Zhang, J., Cuevas, F., Latroche, M., Jensen, T.R., Mechanochemical synthesis of hydrogen storage materials. Prog Mater Sci 58 (2013), 30–75.
16. 2 gas sorption analysis to form ternary complex hydrides (TM = Fe, Co, Ni). J Phys Chem C 115 (2011), 4971–4979.
17. 2 by high-pressure reactive ball milling. J Alloys Compd 427 (2007), 204–208.
18. 0.5 obtained by reactive milling. Nanotechnology 20 (2009), 204010–204017.
19. 4 synthesis and decomposition reactions. Int J Hydrogen Energy 38 (2013), 4003–4010.
20. 5 studied using in situ synchrotron X-ray diffraction. Int J Hydrogen Energy 36:17 (2011), 10760–10770.
21. 6 studied by in-situ synchrotron X-ray diffraction and high-pressure DSC. Int J Hydrogen Energy 35 (2010), 3578–3582.
22. [22] Mamatha, M., Weidenthaler, C., Pommerin, A., Felderhoff, M., Schuth, F., Comparative studies of the decomposition of alanates followed by in situ XRD and DSC methods. J Alloys Compd 416 (2006), 303–314.
23. 4-based hydrogen storage material using milling under low pressure hydrogen atmosphere. J Alloys Compd 430 (2007), 350–355.
24. [24] Jeloaica, L., Cuevas-Zhang, J.X., Cuevas, F., Latroche, M., Raybaud, P., Thermodynamic properties of trialkali (Li, Na, K) hexa-alanates: a combined DFT and experimental study. J Phys Chem C 112 (2008), 18598–18607.
25. 6 (n = 0, 1, 2) alanates synthesized by high-pressure reactive ball milling. J Phys Chem C 113 (2009), 21242–21252.
26. [26] Arnbjerg, Lene Mosegaard, Jensen, Torben R., New compounds in the potassium-aluminium-hydrogen system observed during release and uptake of hydrogen. Int J Hydrogen Energy 37 (2012), 345–356.
27. [27] Li, Z., Zhang, J., Wang, S., Jiang, L., Latroche, M., Du, J., et al. Mechanochemistry of lithium nitride under hydrogen gas. Phys Chem Chem Phys 17 (2015), 21927–21934.
28. [28] Bellosta von Colbe, J.M., Felderhoff, M., Bogdanovic, B., Schuth, F., Weidenthaler, C., One-step direct synthesis of a Ti-doped sodium alanate hydrogen storage material. Chem Commun, 2005, 4732–4734.
29. 2 nanocomposites prepared by reactive ball milling under hydrogen gas. Phys Chem Chem Phys 14 (2012), 1200–1211.
30. 2 nanocomposites. J Phys Chem C 117 (2013), 18851–18862.
31. 2-based mixtures. Int J Hydrogen Energy 39 (2014), 9924–9930.
32. [32] Zhang, J., Li, Z., Cuevas, F., Latroche, M., Phase stabilities in the Mg-Si-H system tuned by mechanochemistry”. J Phys Chem C 118 (2014), 21889–21895.
33. [33] Ravnsbæk, Dorthe, Filinchuk, Yaroslav, Cerenius, Yngve, Jakobsen, Hans Jørgen, Besenbacher, Flemming, Skibsted, Jørgen, et al. A series of mixed-metal borohydrides. Angew Chem Int Ed 48 (2009), 6659–6663.
34. 4 by gas–solid reaction. Chem Eur J 15 (2009), 5531–5534.
35. [35] Friedrichs, O., Remhof, A., Borgschulte, A., Buchter, F., Orimo, S., Züttel, A., Breaking the passivation—the road to a solvent fee borohydride synthesis. Phys Chem Chem Phys 12 (2010), 10919–10922.
36. 4. Chem Mater, 22, 2010 3265–3268 3265.
37. 3Cl. J Phys Chem C, 2011, 23591–23602.
38. 3Cl, M = La or Gd. J Phys Chem C 116 (2012), 21267–21276.
39. 3Cl, a new lithium-ion conductor and hydrogen storage material with isolated tetranuclear anionic clusters. Chem Mater 24 (2012), 1654–1663.
40. 4 (M = Mg, Mn): on the structural diversity. J Phys Chem C 116 (2012), 10829–10840.
41. 15 (M = Mg, Mn), containing two weakly interconnected frameworks. Inorg Chem 52 (2013), 9941–9947.
42. 3Cl. J Phys Chem C 117 (2013), 14965–14972.
43. [43] Schouwink, Pascal, Ley, Morten B., Tissot, Antoine, Hagemann, Hans, Jensen, Torben R., Smrčok, Lubomir, et al. Structure and properties of complex hydride perovskite material. Nat Comm, 5, 2014, 5706.
44. [44] Schouwink, P., Ley, M.B., Jensen, T.R., Smrčok, L., Černý, R., Borohydrides: from sheet to framework topologies. Dalton Trans 43 (2014), 7726–7733.
45. [45] Sadikin, Yolanda, Stare, Katarina, Schouwink, Pascal, Ley, Morten Brix, Jensen, Torben R., Meden, Anton, et al. Alkali metal – yttrium borohydrides: the link between coordination of small and large rare-earth. J Solid State Chem 225 (2015), 231–239.
46. [46] Paskevicius, Mark, Ley, Morten B., Sheppard, Drew A., Jensen, Torben R., Buckley, Craig E., Eutectic melting in metal borohydrides. Phys Chem Chem Phys 15 (2013), 19774–19789.
47. 3 (M = Y or Gd). Dalton Trans 43:35 (2014), 13333–13342.
48. 2 composites. Energies 8 (2015), 2701–2713, 10.3390/en8042701.
49. [49] Moury, R., Demirci, U., Ban, V., Filinchuk, Y., Ichikawa, T., Zeng, L., et al. Lithium hydrazinidoborane: a polymorphic material with potential for chemical hydrogen storage. Chem Mater 26:10 (2014), 3249–3255.
50. [50] Moury, R., Demirci, U.B., Ichikawa, T., Filinchuk, Y., Chiriac, R., van der Lee, A., et al. Sodium hydrazinidoborane: a chemical hydrogen-storage material. ChemSusChem 6:4 (2013), 667–673.
51. [51] Dovgaliuk, I., Ban, V., Sadikin, Y., Cerný, R., Aranda, L., Casati, N., et al. The first halide-free bimetallic aluminum borohydride: synthesis, structure, stability, and decomposition pathway. J Phys Chem C 118:1 (2014), 145–153.
52. 3. Energies 8:8 (2015), 8286–8299.
53. 2. J Mater Chem A 3 (2015), 691–698.
54. [54] Richter, Bo, Ravnsbæk, Dorthe B., Tumanov, Nikolay, Filinchuk, Yaroslav, Jensen, Torben R., Manganese borohydride; synthesis and characterization. Dalton Trans 44 (2015), 3988–3996.
55. 2: insight into intermediate compounds. Dalton 44 (2015), 6571–6580.
56. [56] Jepsen, Lars H., Ley, Morten B., Filinchuk, Yaroslav, Besenbacher, Flemming, Jensen, Torben R., Tailoring the properties of ammine metal borohydrides for solid-state hydrogen storage. ChemSusChem 8 (2015), 1452–1463.
57. [57] Jepsen, Lars H., Lee, Young-Su, Černý, Radovan, Sarusie, Ram S., Cho, Young Whan, Besenbacher, Flemming, et al. Ammine calcium and strontium borohydrides: syntheses, structures and properties. ChemSusChem 8 (2015), 3472–3482.
58. 2. J Phys Chem C 118 (2014), 12141–12153.
59. [59] Dovgaliuk, I., Le Duff, C.S., Robeyns, K., Devillers, M., Filinchuk, Y., Mild dehydrogenation of ammonia borane complexed with aluminum borohydride. Chem Mater 27 (2015), 768–777.
60. 2: an ultradense complex hydride showing a reversible transition to the porous framework. J Phys Chem C 118 (2014), 23402–23408.
61. 2 reveals a stable polymorph with high hydrogen density. Chem Mater 28 (2016), 274–283.
62. [62] Calizzi, M., Venturi, F., Ponthieu, M., Cuevas, F., Morandi, V., Perkisas, T., et al. Gas-phase synthesis of Mg-Ti nanoparticles for solid-state hydrogen storage. Phys Chem Chem Phys 18 (2016), 141–148.
63. [63] Mooij, L.P.A., Baldi, A., Boelsma, C., Shen, K., Wagemaker, M., Pivak, Y., et al. Interface energy controlled thermodynamics of nanoscale metal hydrides. Adv Energy Mater 1 (2011), 754–758.
64. [64] Mooij, Lennard, Perkisas, Tyche, Palsson, Gunnar, Schreuders, Herman, Wolff, Max, Hjorvarsson, Bjorgvin, et al. The effect of microstructure on the hydrogenation of Mg/Fe thin film multilayers. Int J Hydrogen Energy 39 (2014), 17092–17103.
65. [65] Mooij, L., Dam, B., Hysteresis and the role of nucleation and growth in the hydrogenation of Mg nanolayers. Phys Chem Chem Phys, 15, 2013, 2782.
66. [66] Mooij, L., Dam, B., Nucleation and growth mechanisms of nano-magnesium hydride from the Hydrogen sorption kinetics. Phys Chem Chem Phys 15 (2013), 11501–11510.
67. [67] Schlichtenmayer, M., Hirscher, M., Nanosponges for hydrogen storage. J Mater Chem 22 (2012), 10134–10143.
68. [68] Klein, N., Senkovska, I., Baburin, I.A., Grünker, R., Stoeck, U., Schlichtenmayer, M., et al. Route to a family of robust, non-interpenetrated metal-organic frameworks with pto-like topology. Chem A Eur J 17 (2011), 13007–13016.
69. [69] Streppel, B., Hirscher, M., BET specific surface area and pore structure of MOFs determined by hydrogen adsorption at 20 K. Phys Chem Chem Phys 13 (2011), 3220–3222.
70. [70] Oh, H., Lupu, D., Blanita, G., Hirscher, M., Experimental assessment of Physical upper limit for hydrogen storage capacity at 20 K in densified MIL-101 monoliths. RSC Adv 4 (2014), 2648–2651.
71. 2. J Am Chem Soc 129 (2007), 11172–11176.
72. [72] Szilágyi, P.Á., Weinrauch, I., Oh, H., Hirscher, M., Juan-Alcañiz, J., Serra-Crespo, P., et al. Interplay of linker functionalization and hydrogen adsorption in the metal−organic framework MIL-101. J Phys Chem C 118 (2014), 19572–19579.
73. [73] Filinchuk, Y., Richter, B., Jensen, T.R., Dmitriev, V., Chernyshov, D., Hagemann, H., Porous and dense magnesium borohydride frameworks: synthesis, stability, and reversible absorption of guest species. Angew Chem Int Ed 50 (2011), 11162–11166.
74. [74] Roduner, E., Size matters: why nanomaterials are different. Chem Soc Rev 35 (2006), 583–592.
75. [75] Hu, W., Xiao, S., Deng, H., Luo, W., Deng, L., Thermodynamic properties of nano-silver and alloy particles. PozoPerez, D., (eds.) Silver nanoparticles, 2010, InTech, Vukovar, Croatia, 1–3.
76. [76] Hashmi, A.S.K., Hutchings, G.J., Gold catalysis. Angew Chem Int Ed 45 (2006), 7896–7936.
77. [77] Lai, Q., Paskevicius, M., Sheppard, D.A., Buckley, C.E., Thornton, A.W., Hill, M.R., et al. Hydrogen storage materials for mobile and stationary applications: current state of the art. ChemSusChem 8 (2015), 2789–2825.
78. [78] Zlotea, C., Latroche, M., Role of nanoconfinement on hydrogen sorption properties of metal nanoparticles hybrids. Colloid Surfaces A Physicochem Eng Aspects 439 (2013), 117–130.
79. [79] de Jongh, P.E., Adelhelm, P., Nanosizing and nanoconfinement: new strategies towards meeting hydrogen storage goals. Chemsuschem 3 (2010), 1332–1348.
80. [80] Nielsen, T.K., Besenbacher, F., Jensen, T.R., Nanoconfined hydrides for energy storage. Nanoscale 3 (2011), 2086–2098.
81. [81] Pasquini, L., Callini, E., Piscopiello, E., Montone, A., VittoriAntisari, M., Bonetti, E., Metal-hydride transformation kinetics in magnesium nanoparticles. Appl Phys Lett, 94, 2009, 041918.
82. [82] Vons, V.A., Anastasopol, A., Legerstee, W.J., Mulder, F.M., Eijt, S.W.H., Schmidt-Ott, A., Low-temperature hydrogen desorption and the structural properties of spark discharge generated Mg nanoparticles. Acta Mater 59 (2011), 3070–3080.
83. [83] Krishnan, G., Negrea, R.F., Ghica, C., ten Brink, G.H., Kooi, B.J., Palasantzas, G., Synthesis and exceptional thermal stability of Mg-based bimetallic nanoparticles during hydrogenation. Nanoscale, 6, 2014, 11963.
84. [84] Pasquini, L., Sacchi, M., Brighi, M., Boelsma, C., Bals, S., Perkisas, T., et al. Hydride destabilization in core-shell nanoparticles. Int J Hydrogen Energy 39 (2014), 2115–2123.
85. [85] Venturi, F., Calizzi, M., Bals, S., Perkisas, T., Pasquini, L., Self-assembly of gas-phase synthesized magnesium nanoparticles on room temperature substrates. Mater Res Express, 2, 2015, 015007.
86. 2 particles. Adv Funct Mater 24 (2014), 3604–3611.
87. 2 properties during mechanical milling. Int J Hydrogen Energy 32 (2007), 2400–2407.
88. [88] Zlotea, C., Chevalier-César, C., Léonel, E., Leroy, E., Cuevas, F., Dibandjo, P., et al. Synthesis of small metallic Mg-based nanoparticles confined in porous carbon materials for hydrogen sorption. Faraday Disc 151 (2011), 117–131.
89. 4 supported on carbon nanofibers. Angew Chem Int Ed 45 (2006), 3501–3503.
90. 4: prolific effects from increased surface area and pore volume. Nanoscale 6 (2014), 599–607.
91. 4 by confinement in nanoporous carbon. Energy Environ Sci 4 (2011), 4108–4115.
92. 4 in nanoporous carbon scaffolds. J Phys Chem C 112 (2008), 5651–5657.
93. 4. ACS Nano 6 (2012), 7739–7751.
94. [94] Ngene, P., Verkuijlen, M.H.W., Zheng, Q., Kragten, J., van Bentum, P.J.M., Bitter, J.H., et al. The role of Ni in increasing the reversibility of the hydrogen release from nanoconfined LiBH4. Faraday Discuss 151 (2011), 47–58.
95. 4 confined exclusively in nanopores. Acta Mater 59 (2011), 1829–1838.
96. 4–carbon nanocomposites for hydrogen storage. Int J Hydrogen Energy 39 (2014), 10175–10183.
97. [97] Moussa, G., Demirci, U.B., Malo, S., Bernard, S., Miele, P., Hollow core@mesoporous shell boron nitride nanopolyhedron-confined ammonia borane: a pure B-N-H composite for chemical hydrogen storage. J Mater Chem A 2 (2014), 7717–7722.
98. 4 in nanoporous carbon: impact on H2 release, reversibility, and thermodynamics. J Phys Chem C 114 (2010), 4675–4682.
99. [99] Chua, Y.S., Chen, P., Wu, G., Xiong, Z., Development of amidoboranes for hydrogen storage. Chem Commun 47 (2011), 5116–5129.
100. [100] Chua, Y.S., Li, W., Wu, G., Xiong, Z., Chen, P., From exothermic to endothermic dehydrogenation − interaction of monoammoniate of magnesium amidoborane and metal hydrides. Chem Mater 24 (2012), 3574–3581.
101. [101] Chua, Y.S., Wu, H., Zhou, W., Udovic, T.J., Wu, G., Xiong, Z., et al. Monoammoniate of calcium amidoborane: synthesis, structure, and hydrogen-storage properties. Inorg Chem 51 (2012), 1599–1603.
102. 3: structure and hydrogen storage properties. Chem Mater 22 (2010), 3–5.
103. [103] Wu, H., Zhou, W., Pinkerton, F.E., Meyer, M.S., Yao, Q., Gadipelli, S., et al. Sodium magnesium amidoborane: the first mixed-metal amidoborane. Chem Commun 47 (2011), 4102–4204Pubmed.
104. [104] Biliškov, N., Halasz, I., Callini, E., Borgschulte, A., Züttel, A., Synthesis and characterisation of new amidoboranes. Proc. 9th Int. Symp. Hydrogen & Energy, Emmetten, Switzerland, 2015, 28.
105. 2] – the first mixed-cation amidoborane with unusual crystal structure. Dalton Trans 40 (2011), 4407–4413.
106. [106] Dovgaliuk, I., Jepsen, L.H., Safin, D.A., Lodziana, Z., Dyadkin, V., Jensen, T.R., et al. A composite of complex and chemical hydrides yields the first Al-Based amidoborane with improved hydrogen storage properties. Chem Eur J, 2015, 14562–14570.
107. [107] Meilikhov, M., Yusenko, K., Esken, D., Turner, S., Van Tendeloo, G., Fischer, R.A., Metals@ MOFs–loading MOFs with metal nanoparticles for hybrid functions. Eur J Inorg Chem 2010 (2010), 3701–3714.
108. [108] Turner, S., Lebedev, O.I., Schröder, F., Esken, D., Fischer, R.A., Tendeloo, G.V., Direct imaging of loaded metal− organic framework materials (metal@ MOF-5). Chem Mater 20 (2008), 5622–5627.
109. [109] Wiktor, C., Turner, S., Zacher, D., Fischer, R.A., Van Tendeloo, G., Imaging of intact MOF-5 nanocrystals by advanced TEM at liquid nitrogen temperature. Microporous Mesoporous Mater 162 (2012), 131–135.
110. [110] Kalidindi, S.B., Oh, H., Hirscher, M., Esken, D., Wiktor, C., Turner, S., et al. Metal@ COFs: covalent organic frameworks as templates for Pd nanoparticles and hydrogen storage properties of Pd@ COF-102 hybrid material. Chem A Eur J 18 (2012), 10848–10856.
111. [111] Hadermann, J., Abakumov, A., Van Rompaey, S., Perkisas, T., Filinchuk, Y., Van Tendeloo, G., Crystal structure of a lightweight borohydride from submicrometer crystallites by precession electron diffraction. Chem Mater 24:17 (2012), 3401–3405.
112. [112] Broom, D.P., Hydrogen storage materials: the characterisation of their storage properties. 2011, Springer Science & Business Media.
113. [113] Broom, D.P., Webb, C.J., Hurst, K.E., Parilla, P.A., Gennett, T., Brown, C.M., et al. Outlook and challenges for hydrogen storage in nanoporous materials. Appl Phys A, 122, 2016, 151.
114. [114] Zhou, W., Wu, H., Hartman, M.R., Yildirim, T., Hydrogen and methane adsorption in metal-organic frameworks: a high-pressure volumetric study. J Phys Chem C 111 (2007), 16131–16137.
115. [115] Myers, A., Monson, P., Adsorption in porous materials at high pressure: theory and experiment. Langmuir 18 (2002), 10261–10273.
116. [116] Ozdemir, E., Morsi, B.I., Schroeder, K., Importance of volume effects to adsorption isotherms of carbon dioxide on coals. Langmuir 19 (2003), 9764–9773.
117. [117] Spanopoulos, I., Bratsos, I., Tampaxis, Ch, Kourtellaris, A., Charalambopoulou, G., Steriotis, T.A., et al. Enhanced gas-sorption properties of a high surface area, ultramicroporous magnesium formate. CrystEngComm 17 (2015), 532–539.
118. [118] Møller, K.T., Hansen, B.R., Dippel, A.C., Jørgensen, J.E., Jensen, T.R., Characterization of gas-solid reactions using in situ powder X-ray diffraction. Z Anorg Allg Chem 640 (2014), 3029–3043.
119. [119] Hansen, B.R., Møller, K.T., Paskevicius, M., Dippel, A.-C., Walter, P., Webb, C.J., et al. In situ X-ray diffraction environments for high-pressure reactions. J Appl Crystallogr 48 (2015), 1234–1241.
120. [120] Jensen, T.R., Nielsen, T.K., Filinchuk, Y., Jørgensen, J.-E., Cerenius, Y., Gray, E.M., et al. Versatile in situ powder X-ray diffraction cells for solid–gas investigations. J Appl Crystallogr 43 (2010), 1456–1463.
121. [121] Pistidda, C., Santoru, A., Garroni, S., Bergemann, N., Rzeszutek, A., Horstmann, C., et al. First direct study of the ammonolysis reaction in the most common alkaline and alkaline earth metal hydrides by in situ SR-PXD. J Phys Chem C 119 (2015), 934–943.
122. [122] Ravnsbæk, D.B., Filinchuk, Y., Cerný, R., Jensen, T.R., Powder diffraction methods for studies of borohydride-based energy storage materials. Z Kristallogr Cryst Mater 225 (2010), 557–569.
123. [123] Rude, L.H., Nielsen, T.K., Ravnsbaek, D.B., Bösenberg, U., Ley, M.B., Richter, B., et al. Tailoring properties of borohydrides for hydrogen storage: a review. Phys status Solidi (a) 208 (2011), 1754–1773.
124. 4. Phys Chem Chem Phys 16 (2014), 24194–24199.
125. [125] Nickels, E.A., Jones, M.O., David, W.I., Johnson, S.R., Lowton, R.L., Sommariva, M., et al. Tuning the decomposition temperature in complex hydrides: synthesis of a mixed alkali metal borohydride. Angew Chem Int Ed 47 (2008), 2817–2819.
126. 2: stable phases and origins of metallicity. J Am Chem Soc 136:22 (2014), 8100–8109.
127. [127] Trenary, M., Surface and thin film analysis. A compendium of principles, instrumentation, and applications. 2003, Wiley-VCH, Weinheim, Germany.
128. 2 films. Int J Hydrogen Energy 39 (2014), 9865–9870.
129. [129] Ares, J., Leardini, F., Díaz-Chao, P., Ferrer, I., Fernández, J., Sánchez, C., Non-isothermal desorption process of hydrogenated nanocrystalline Pd-capped Mg films investigated by Ion Beam Techniques. Int J Hydrogen Energy 39 (2014), 2587–2596.
130. [130] Kótai, E., Computer methods for analysis and simulation of RBS and ERDA spectra. Nucl Instrum Methods Phys Res Sect B Beam Interact Mater Atoms 85 (1994), 588–596.
131. 2 in reactive hydride composites containing complex borohydrides. J Alloys Compd 440 (2007), L18–L21.
132. 4. J Phys Chem B 109 (2005), 3719–3722.
133. [133] Kissinger, H.E., Reaction kinetics in differential thermal analysis. Anal Chem 29 (1957), 1702–1706.
134. [134] Chaudhary, A.-L., Sheppard, D.A., Paskevicius, M., Pistidda, C., Dornheim, M., Buckley, C.E., Reaction kinetic behaviour with relation to crystallite/grain size dependency in the Mg–Si–H system. Acta Mater 95 (2015), 244–253.
135. 6 reactive hydride composites (M = Mg, then Li, Na, K, Ca). Appl Phys Lett, 107, 2015, 073905.
136. 3 using group IV elements Si, Ge or Sn. J Alloys Compd 623 (2015), 109–116.
137. 2 composite. Int J Hydrogen Energy 38 (2013), 8357–8366.
138. 4 hydrogen storage materials. J Power Sources 205 (2012), 173–179.
139. [139] Pranzas, P.K., Bösenberg, U., Karimi, F., Münning, M., Metz, O., Minella, C.B., et al. Characterization of hydrogen storage materials and systems with photons and neutrons. Adv Eng Mater 13 (2011), 730–736.
140. [140] Pohlmann, C., Röntzsch, L., Kalinichenka, S., Hutsch, T., Kieback, B., Magnesium alloy-graphite composites with tailored heat conduction properties for hydrogen storage applications. Int J Hydrogen Energy 35 (2010), 12829–12836.
141. 10 flakes and expanded natural graphite. J Alloys Compd 509 (2011), S625–S628.
142. [142] Chaise, A., De Rango, P., Marty, P., Fruchart, D., Miraglia, S., Olives, R., et al. Enhancement of hydrogen sorption in magnesium hydride using expanded natural graphite. Int J Hydrogen Energy 34 (2009), 8589–8596.
143. 2 compacted disks. J Alloys Compd 580 (2013), S183–S186.
144. 2 compacts containing expanded natural graphite under a hydrogen atmosphere. Int J Hydrogen Energy 39 (2014), 349–355.
145. 2/expanded natural graphite pellets upon hydrogen cycling. Int J Hydrogen Energy 38 (2013), 1918–1924.
146. [146] Lozano, G.A., Ranong, C.N., Bellosta Von Colbe, J.M., Bormann, R., Hapke, J., Fieg, G., et al. Optimization of hydrogen storage tubular tanks based on light weight hydrides. Int J Hydrogen Energy 37 (2012), 2825–2834.
147. [147] Börries, S., Metz, O., Pranzas, P., Bücherl, T., Söllradl, S., Dornheim, M., et al. Scattering influences in quantitative fission neutron radiography for the in situ analysis of hydrogen distribution in metal hydrides. Nucl Instrum Methods Phys Res Sect A Accel Spectrom Detect Assoc Equip 797 (2015), 158–164.
148. [148] Jensen, P.B., Lysgaard, S., Quaade, U.J., Vegge, T., Designing mixed metal halide ammines for ammonia storage using density functional theory and genetic algorithms. Phys Chem Chem Phys 16 (2014), 19732–19740, 10.1039/c4cp03133d.
149. [149] Jensen, P.B., Bialy, A., Blanchard, D., Lysgaard, S., Reumert, A.K., Quaade, U.J., et al. Accelerated DFT-based design of materials for ammonia storage. Chem Mater, 2015, 10.1021/acs.chemmater.5b00446 150603150920000.
150. 2 doped with 3d transition metals. Int J Hydrogen Energy 39 (2014), 5874–5887, 10.1016/j.ijhydene.2014.01.172.
151. [151] Holland, J.H., Adaptation in natural and artificial systems. 1975, University of Michigan Press, Ann Arbor.
152. [152] Forrest, S., Genetic algorithms: principles of natural selection applied to computation. Sci (80- ) 261 (1993), 872–878, 10.1126/science.8346439.
153. [153] Deaven, D.M., Ho, K.M., Molecular-geometry optimization with a genetic algorithm. Phys Rev Lett 75 (1995), 288–291.
154. [154] Lysgaard, S., Landis, D.D., Bligaard, T., Vegge, T., Genetic algorithm procreation operators for alloy nanoparticle catalysts. Top Catal 57 (2014), 33–39, 10.1007/s11244-013-0160-9.
155. 2 reduction. Phys Chem Chem Phys 27 (2015), 4552–4561.
156. [156] Klerke, A., Christensen, C.H., Nørskov, J.K., Vegge, T., Ammonia for hydrogen storage: challenges and opportunities. J Mater Chem 18 (2008), 2304–2310, 10.1039/b720020j.
157. [157] Sørensen, R.Z., Hummelshøj, J.S., Klerke, A., Reves, J.B., Vegge, T., Nørskov, J.K., et al. Indirect, reversible high-density hydrogen storage in compact metal ammine salts. J Am Chem Soc 130 (2008), 8660–8668, 10.1021/ja076762c.
158. [158] Hussain, T., Pathak, B., Ramzan, M., Maark, T.A., Ahuja, R., Calcium doped graphane as a hydrogen storage material. Appl Phys Lett 100: 183-902 (2012), 1–5.
159. [159] Hussain, T., Pathak, B., Maark, T.A., Araujo, Araujo C.M., Scheicher, R.H., Ahuja, R., Ab initio study of lithium-doped graphane for hydrogen storage. Eur Phys Lett 96:27013 (2011), p1–p4.
160. [160] Hussain, T., Chakraborty, S., Ahuja, R., Metal-functionalized silicene for efficient hydrogen storage. ChemPhysChem 14 (2013), 3463–3466.
161. [161] Hussain, T., Kaewmaraya, T., Chakraborty, S., Ahuja, R., Functionalization of hydrogenated silicene with alkali and alkaline earth metals for efficient hydrogen storage. Phys Chem Chem Phys, 15, 2013, 18900.
162. [162] Orimo, S.-I., Nakamori, Y., Eliseo, J.R., Züttel, A., Jensen, C.M., Complex hydrides for hydrogen storage. Chem Rev 107 (2007), 4111–4132, 10.1021/cr0501846.
163. [163] Sakintuna, B., Lamari-Darkrim, F., Hirscher, M., Metal hydride materials for solid hydrogen storage: a review. Int J Hydrogen Energy 32 (2007), 1121–1140, 10.1016/j.ijhydene.2006.11.022.
164. [164] Churchard, A.J., Banach, E., Borgschulte, A., Caputo, R., Chen, J.-C., Clary, D., et al. A multifaceted approach to hydrogen storage. Phys Chem Chem Phys, 2011, 16955–16972, 10.1039/c1cp22312g.
165. x system – an experimental and theoretical study. Int J Hydrogen Energy 38 (2013), 12213–12222, 10.1016/j.ijhydene.2013.05.154.
166. x system – an experimental and theoretical study. Int J Hydrogen Energy 40 (2015), 8548–8561, 10.1016/j.ijhydene.2015.04.076.
167. [167] Christensen, C.H., Sørensen, R.Z., Johannessen, T., Quaade, U.J., Honkala, K., Elmøe, T.D., et al. Metal ammine complexes for hydrogen storage. J Mater Chem 15 (2005), 4106–4108, 10.1039/b511589b.
168. [168] Vegge, T., Sørensen, R.Z., Klerke, A., Hummelshøj, J.S., Johannessen, T., Nørskov, J.K., et al. Indirect hydrogen storage in metal ammines. Walker, G., (eds.) Solid state Hydrog. storage Mater. Chem, 2008, British Welding Research Association, 533–568.
169. [169] Tekin, A., Hummelshøj, J.S., Jacobsen, H.S., Sveinbjörnsson, D., Blanchard, D., Nørskov, J.K., et al. Ammonia dynamics in magnesium ammine from DFT and neutron scattering. Energy Environ Sci 3 (2010), 448–456, 10.1039/b921442a.
170. [170] Ammitzboll, A.L., Lysgaard, S., Klukowska, A., Vegge, T., Quaade, U.J., Surface adsorption in strontium chloride ammines. J Chem Phys, 138, 2013, 164701, 10.1063/1.4800754.
171. [171] Lysgaard, S., Ammitzbøll, A.L., Johnsen, R.E., Norby, P., Quaade, U.J., Vegge, T., Resolving the stability and structure of strontium chloride amines from equilibrium pressures, XRD and DFT. Int J Hydrogen Energy 37 (2012), 18927–18936, 10.1016/j.ijhydene.2012.09.129.
172. 2. J Phys Chem C 118 (2014), 24349–24356, 10.1021/jp508076c.
173. [173] Dion, M., Rydberg, H., Schröder, E., Langreth, D.C., Lundqvist, B.I., Van der Waals Density Functional for General Geometries. Phys Rev Lett, 92, 2004, 246401, 10.1103/PhysRevLett.92.246401.
174. [174] Bialy, A., Jensen, P.B., Blanchard, D., Vegge, T., Quaade, U.J., Solid solution barium–strontium chlorides with tunable ammonia desorption properties and superior storage capacity. J Solid State Chem 221 (2015), 32–36, 10.1016/j.jssc.2014.09.014.
175. [175] Vegge, T., Locating the rate-limiting step for the interaction of hydrogen with Mg ( 0001 ) using density-functional theory calculations and rate theory. Phys Rev B, 70, 2004, 035412, 10.1103/PhysRevB.70.035412.
176. 2 electronic structure. Acta Phys Pol A 120 (2011), 238–241.
177. 2 (001) surface. EPL (Europhysics Lett), 101, 2013, 27006, 10.1209/0295-5075/101/27006.
178. 2 upon transition metals doping: a hybrid density functional calculations. AIP Adv 102117 (2013), 0–8, 10.1063/1.4826521.
179. 2 (1 1 0) surface by means of doping and mechanical strain. Comput Mater Sci 86 (2014), 165–169, 10.1016/j.commatsci.2014.01.029.
180. 2: the role of iron catalyst. Int J Hydrogen Energy 38 (2013), 15254–15263, 10.1016/j.ijhydene.2013.09.132.
181. 2 nanoclusters. Proc Natl Acad Sci U S A 105 (2008), 8227–8231, 10.1073/pnas.0711743105.
182. 2. Int J Hydrogen Energy 39:2 (2014), 862–867.
183. [183] Hussain, T., Sarkar, A.D., Ahuja, R., Strain induced lithium functionalized graphane as a high capacity hydrogen storage material. Appl Phys Lett 101:103-907 (2012), 1–5.
184. [184] Hussain, T., Chakraborty, S., Sarkar, A.D., Johansson, B., Ahuja, R., Enhancement of energy storage capacity of Mg functionalized silicene and silicane under external strain. Appl Phys Lett, 105, 2014, 123903.
185. 4. Phys Rev B, 89, 2014, 134308, 10.1103/PhysRevB.89.134308.
186. [186] Saldan, I., A prospect for LiBH4 as on-board hydrogen storage. Cent Eur J Chem 9 (2011), 761–775, 10.2478/s11532-011-0068-9.
187. 4 as a fast lithium ion conductor. Adv Funct Mater 25 (2015), 184–192, 10.1002/adfm.201402538.
188. [188] Łodziana, Z., Błoński, P., Yan, Y., Rentsch, D., Remhof, A., NMR chemical shifts of 11B in metal borohydrides from first-principle calculations. J Phys Chem C 118 (2014), 6594–6603, 10.1021/jp4120833.
189. 11B NMR chemical shifts calculations. Int J Hydrogen Energy 39 (2014), 9842–9847, 10.1016/j.ijhydene.2014.02.150.
190. 4 nanoclusters interaction with models of porous carbon and silica scaffolds. Int J Hydrogen Energy 39 (2014), 9848–9853, 10.1016/j.ijhydene.2014.03.264.
191. [191] Li, Y., Hussain, T., Sarkar, A.D., Ahuja, R., Hydrogen storage in polylithiated BC3 monolayer sheet. Solid State Commun, 170, 2013, 39.
192. 3 sheet functionalized with lithium rich species emerging as a reversible hydrogen storage material. ChemPhysChem, 16, 2015, 634.
193. 2) functionalized graphane as a potential hydrogen storage material. Appl Phys Lett, 101, 2012, 243902.
194. [194] Hussain, T., Sarkar, A.D., Johansson, B., Ahuja, R., Functionalization of hydrogenated graphene by polylithiated species for efficient hydrogen storage. Int J Hydrogen Energy 39 (2014), 2560–2566.