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Molecular Simulation Volume 31, 2005 - Issue 6-7: Computational and Experimental Nanoscience
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Original Articles

Quantum nature of adsorbed hydrogen on single-wall carbon nanohorns

H. Tanaka Diversity and Fractal Science, Graduate School of Science and Technology, Chiba University, 1-33 Yayoi, Inage, Chiba, 263-8522, Japan
,
J. Fan SORST, Japan Science and Technology Agency, c/o NEC Corporation, 34 Miyukigaoka, Tsukuba, 305-8501, Japan
,
H. Kanoh Department of Chemistry, Faculty of Science, Chiba University, 1-33 Yayoi, Inage, Chiba, 263-8522, Japan
,
M. Yudasaka SORST, Japan Science and Technology Agency, c/o NEC Corporation, 34 Miyukigaoka, Tsukuba, 305-8501, Japan; NEC Corporation, 34 Miyukigaoka, Tsukuba, 305-8501, Japan
,
S. Iijima SORST, Japan Science and Technology Agency, c/o NEC Corporation, 34 Miyukigaoka, Tsukuba, 305-8501, Japan; NEC Corporation, 34 Miyukigaoka, Tsukuba, 305-8501, Japan; Department of Physics, Meijo University, 1-501 Shiogamaguchi, Tenpaku, Nagoya, 468-8502, Japan
&
K. Kaneko Department of Chemistry, Faculty of Science, Chiba University, 1-33 Yayoi, Inage, Chiba, 263-8522, JapanCorrespondence[email protected]
Pages 465-474 | Received 01 Nov 2004, Accepted 01 Dec 2004, Published online: 22 Aug 2006

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Qing Xu, Dahuan Liu, Qingyuan Yang & Chongli Zhong. (2009) Molecular simulation study of the quantum effects of hydrogen adsorption in metal-organic frameworks: influences of pore size and temperature. Molecular Simulation 35:9, pages 748-754.
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Articles from other publishers (33)

Ahmet Kose, Numan Yuksel & M. Ferdi Fellah. (2022) Hydrogen adsorption on Ni doped carbon nanocone. Diamond and Related Materials 124, pages 108921.
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Eugene Ustinov, Hideki Tanaka & Minoru Miyahara. (2019) Low-temperature hydrogen-graphite system revisited: Experimental study and Monte Carlo simulation. The Journal of Chemical Physics 151:2.
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Sylwester Furmaniak, Piotr A. Gauden, Andrzej Patrykiejew, Radosław Miśkiewicz & Piotr Kowalczyk. (2018) Carbon Nanohorns as Reaction Nanochambers – a Systematic Monte Carlo Study. Scientific Reports 8:1.
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Yi-Han Cheng, Chuan-Yu Zhang, Juan Ren & Kai-Yu Tong. (2016) Hydrogen storage in Li-doped fullerene-intercalated hexagonal boron nitrogen layers. Frontiers of Physics 11:5.
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Hyunchul Oh & Michael Hirscher. (2016) Quantum Sieving for Separation of Hydrogen Isotopes Using MOFs. European Journal of Inorganic Chemistry 2016:27, pages 4278-4289.
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Artur Terzyk, Piotr Gauden, Sylwester Furmaniak, Karolina Ciećwierz, Piotr Kowalczyk & Marek Wiśniewski. 2016. Carbon Nanomaterials Sourcebook. Carbon Nanomaterials Sourcebook 75 114 .
M. S. Barabashko, M. I. Bagatskii & V. V. Sumarokov. 2015. Nanotechnology in the Security Systems. Nanotechnology in the Security Systems 121 130 .
Y. Hattori, K. Kaneko & T. Ohba. 2013. Comprehensive Inorganic Chemistry II. Comprehensive Inorganic Chemistry II 25 44 .
A. Martínez-Mesa, L. Zhechkov, S. N. Yurchenko, T. Heine, G. Seifert & J. Rubayo-Soneira. (2012) Hydrogen Physisorption on Carbon Foams upon Inclusion of Many-Body and Quantum Delocalization Effects. The Journal of Physical Chemistry C 116:36, pages 19543-19553.
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Jinjun Cai, Yanlong Xing & Xuebo Zhao. (2012) Quantum sieving: feasibility and challenges for the separation of hydrogen isotopes in nanoporous materials. RSC Advances 2:23, pages 8579.
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A. Martínez-Mesa, S. N. Yurchenko, S. Patchkovskii, T. Heine & G. Seifert. (2011) Influence of quantum effects on the physisorption of molecular hydrogen in model carbon foams. The Journal of Chemical Physics 135:21.
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Jianxun Xu, Hiroyuki Tomimoto & Tomonobu Nakayama. (2011) What is inside carbon nanohorn aggregates?. Carbon 49:6, pages 2074-2078.
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Daisuke Noguchi, Hideki Tanaka, Toshihiko Fujimori, Hirotoshi Kagita, Yoshiyuki Hattori, Hiroaki Honda, Koki Urita, Shigenori Utsumi, Zheng-Ming Wang, Tomonori Ohba, Hirofumi Kanoh, Kenji Hata & Katsumi Kaneko. (2010) Selective D 2 adsorption enhanced by the quantum sieving effect on entangled single-wall carbon nanotubes . Journal of Physics: Condensed Matter 22:33, pages 334207.
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A. Gotzias, H. Heiberg-Andersen, M. Kainourgiakis & Th. Steriotis. (2010) Grand canonical Monte Carlo simulations of hydrogen adsorption in carbon cones. Applied Surface Science 256:17, pages 5226-5231.
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Matthew R. LaBrosse & J. Karl Johnson. (2010) Defect and Nondefect Interstitial Channel Availability in Carbon Nanotube Bundles: Comparison of Modeling with Experiments. The Journal of Physical Chemistry C 114:17, pages 7602-7610.
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Amir Abbas Rafati, Sayed Majid Hashemianzadeh, Zabiollah Bolboli Nojini & Negin Naghshineh. (2010) Canonical Monte Carlo simulation of adsorption of O 2 and N 2 mixture on single walled carbon nanotube at different temperatures and pressures . Journal of Computational Chemistry, pages NA-NA.
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Hideki Tanaka, Daisuke Noguchi, Akiko Yuzawa, Tetsuya Kodaira, Hirofumi Kanoh & Katsumi Kaneko. (2009) Quantum Effects on Hydrogen Isotopes Adsorption in Nanopores. Journal of Low Temperature Physics 157:3-4, pages 352-373.
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Piotr Kowalczyk, Piotr A Gauden, Artur P Terzyk & Sylwester Furmaniak. (2009) Impact of the carbon pore size and topology on the equilibrium quantum sieving of hydrogen isotopes at zero coverage and finite pressures. Journal of Physics: Condensed Matter 21:14, pages 144210.
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Piotr Kowalczyk, Piotr A. Gauden & Artur P. Terzyk. (2008) Cryogenic Separation of Hydrogen Isotopes in Single-Walled Carbon and Boron-Nitride Nanotubes: Insight into the Mechanism of Equilibrium Quantum Sieving in Quasi-One-Dimensional Pores. The Journal of Physical Chemistry B 112:28, pages 8275-8284.
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Daisuke Noguchi, Hideki Tanaka, Atsushi Kondo, Hiroshi Kajiro, Hiroshi Noguchi, Tomonori Ohba, Hirofumi Kanoh & Katsumi Kaneko. (2008) Quantum Sieving Effect of Three-Dimensional Cu-Based Organic Framework for H 2 and D 2 . Journal of the American Chemical Society 130:20, pages 6367-6372.
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Vaiva Krungleviciute, M. Mercedes Calbi, Jeff A. Wagner, Aldo D. Migone, Masako Yudasaka & Sumio Iijima. (2008) Probing the Structure of Carbon Nanohorn Aggregates by Adsorbing Gases of Different Sizes. The Journal of Physical Chemistry C 112:15, pages 5742-5746.
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M. Arai, M. Kanamaru, T. Matsumura, Y. Hattori, S. Utsumi, T. Ohba, H. Tanaka, C. M. Yang, H. Kanoh, F. Okino, H. Touhara & K. Kaneko. (2007) Pore characterization of assembly-structure controlled single wall carbon nanotube. Adsorption 13:5-6, pages 509-514.
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Piotr Kowalczyk, Lorenzo Brualla, Andrzej Żywociński & Suresh K. Bhatia. (2007) Single-Walled Carbon Nanotubes:  Efficient Nanomaterials for Separation and On-Board Vehicle Storage of Hydrogen and Methane Mixture at Room Temperature?. The Journal of Physical Chemistry C 111:13, pages 5250-5257.
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M. Konstantakou, Th.A. Steriotis, G.K. Papadopoulos, M. Kainourgiakis, E.S. Kikkinides & A.K. Stubos. (2007) Characterization of nanoporous carbons by combining CO2 and H2 sorption data with the Monte Carlo simulations. Applied Surface Science 253:13, pages 5715-5720.
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Daniel E. Shai, Milton W. Cole & Paul E. Lammert. (2007) Adsorption of Quantum Gases on Curved Surfaces. Journal of Low Temperature Physics 147:1-2, pages 59-79.
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Serguei Patchkovskii & Thomas Heine. (2007) Evaluation of the adsorption free energy of light guest molecules in nanoporous host structures. Physical Chemistry Chemical Physics 9:21, pages 2697.
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Piotr Kowalczyk, Robert Hołyst, Mauricio Terrones & Humberto Terrones. (2007) Hydrogen storage in nanoporous carbon materials: myth and facts. Phys. Chem. Chem. Phys. 9:15, pages 1786-1792.
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Piotr Kowalczyk & Suresh K. Bhatia. (2006) Optimization of Slitlike Carbon Nanopores for Storage of hythane Fuel at Ambient Temperatures. The Journal of Physical Chemistry B 110:47, pages 23770-23776.
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Piotr Kowalczyk, Lech Solarz, D. D. Do, Adam Samborski & J. M. D. MacElroy. (2006) Nanoscale Tubular Vessels for Storage of Methane at Ambient Temperatures. Langmuir 22:21, pages 9035-9040.
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Piotr Kowalczyk & J. M. D. MacElroy. (2006) Equilibrium Properties of Dense Hydrogen Isotope Gases Based on the Theory of Simple Fluids. The Journal of Physical Chemistry B 110:30, pages 14971-14975.
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Piotr Kowalczyk, Mietek JaroniecLech Solarz, Artur P. Terzyk & Piotr A. Gauden. (2016) Grand Canonical Monte Carlo Simulation Study of Hydrogen Storage in Ordered Mesoporous Carbons at 303 K. Adsorption Science & Technology 24:5, pages 411-426.
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Yoshiyuki Hattori, Hideki Tanaka, Fujio Okino, Hidekazu Touhara, Yoshitaka Nakahigashi, Shigenori Utsumi, Hirofumi Kanoh & Katsumi Kaneko. (2006) Quantum Sieving Effect of Modified Activated Carbon Fibers on H 2 and D 2 Adsorption at 20 K . The Journal of Physical Chemistry B 110:20, pages 9764-9767.
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Piotr Kowalczyk, Robert Hołyst, Artur P. Terzyk & Piotr A. Gauden. (2006) State of Hydrogen in Idealized Carbon Slitlike Nanopores at 77 K. Langmuir 22:5, pages 1970-1972.
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