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2018 Journal Article Hydrogenated defective graphene as an anode material for sodium and calcium ion batteries: a density functional theory studyFarokh Niaei, Amir H., Hussain, Tanveer, Hankel, Marlies and Searles, Debra J. (2018). Hydrogenated defective graphene as an anode material for sodium and calcium ion batteries: a density functional theory study. Carbon, 136, 73-84. doi: 10.1016/j.carbon.2018.04.034 |
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2018 Journal Article Coordination of atomic Co–Pt coupling species at carbon defects as active sites for oxygen reduction reactionZhang, Longzhou, Fischer, Julia Melisande Theresa Agatha, Jia, Yi, Yan, Xuecheng, Xu, Wei, Wang, Xiyang, Chen, Jun, Yang, Dongjiang, Liu, Hongwei, Zhuang, Linzhou, Hankel, Marlies, Searles, Debra J., Huang, Keke, Feng, Shouhua, Brown, Christopher L. and Yao, Xiangdong (2018). Coordination of atomic Co–Pt coupling species at carbon defects as active sites for oxygen reduction reaction. Journal of the American Chemical Society, 140 (34), 10757-10763. doi: 10.1021/jacs.8b04647 |
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2018 Journal Article Interaction of boron nitride nanotubes with aluminum: a computational studyRohmann, Christoph, Yamakov, Vesselin I., Park, Cheol, Fay, Catharine, Hankel, Marlies and Searles, Debra J. (2018). Interaction of boron nitride nanotubes with aluminum: a computational study. The Journal of Physical Chemistry C, 122 (27), 15226-15240. doi: 10.1021/acs.jpcc.8b00774 |
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2018 Journal Article How Low Nucleation Density of Graphene on CuNi Alloy is AchievedLiu, Yifan, Wu, Tianru, Yin, Yuling, Zhang, Xuefu, Yu, Qingkai, Searles, Debra J., Ding, Feng, Yuan, Qinghong and Xie, Xiaoming (2018). How Low Nucleation Density of Graphene on CuNi Alloy is Achieved. Advanced Science, 5 (6) 1700961, 1700961. doi: 10.1002/advs.201700961 |
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2018 Conference Publication Solution properties of thermally sensitive macromolecules studied by high resolution NMR and MD simulationsCheng Zhang, Wen Li, Lianxiao Liu, James Reid, Stefano Bernardi, Debra J. Searles, Hui Peng, Afang Zhang and Andrew K. Whittaker (2018). Solution properties of thermally sensitive macromolecules studied by high resolution NMR and MD simulations. 255th ACS National Meeting & Exposition, New Orleans, LA, 18-22 March 2018. WASHINGTON: AMER CHEMICAL SOC. |
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2018 Conference Publication Interaction of carbon and boron nitride nanotubes with metalsRohmann, Christoph, Searles, Debra and Zwolak, Michael (2018). Interaction of carbon and boron nitride nanotubes with metals. 255th National Meeting and Exposition of the American Chemical Society (ACS) - Nexus of Food, Energy, and Water, New Orleans, LA, United States, 18-22 March, 2018. Washington, DC United States: American Chemical Society. |
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2017 Journal Article Influence of Constraints within a Cyclic Polymer on Solution PropertiesHossain, Md. D., Reid, James C., Lu, Derong, Jia, Zhongfan, Searles, Debra J. and Monteiro, Michael J. (2017). Influence of Constraints within a Cyclic Polymer on Solution Properties. Biomacromolecules, 19 (2), 616-625. doi: 10.1021/acs.biomac.7b01690 |
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2017 Journal Article Capacitance-enhanced sodium-ion storage in nitrogen-rich hard carbonGaddam, Rohit Ranganathan, Niaei, Amir H. Farokh, Hankel, Marlies, Searles, Debra J., Kumar, Nanjundan Ashok and Zhao, X. S. (2017). Capacitance-enhanced sodium-ion storage in nitrogen-rich hard carbon. Journal of Materials Chemistry A, 5 (42), 22186-22192. doi: 10.1039/C7TA06754B |
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2017 Journal Article Enhanced CO2 photocatalytic reduction on alkali-decorated graphitic carbon nitrideSun, Zhuxing, Fischer, Julia Melisande Theresa Agatha, Li, Qian, Hu, Jing, Tang, Qijun, Wang, Haiqiang, Wu, Zhongbiao, Hankel, Marlies, Searles, Debra J. and Wang, Lianzhou (2017). Enhanced CO2 photocatalytic reduction on alkali-decorated graphitic carbon nitride. Applied Catalysis B-Environmental, 216, 146-155. doi: 10.1016/j.apcatb.2017.05.064 |
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2017 Journal Article Improving sensing of sulfur-containing gas molecules with ZnO monolayers by implanting dopants and defectsHussain, Tanveer, Hankel, Marlies and Searles, Debra J. (2017). Improving sensing of sulfur-containing gas molecules with ZnO monolayers by implanting dopants and defects. Journal of Physical Chemistry C, 121 (44), 24365-24375. doi: 10.1021/acs.jpcc.7b04923 |
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2017 Journal Article Ergodicity of non-hamiltonian equilibrium systemsEvans, Denis J., Williams, Stephen R., Rondoni, Lamberto and Searles, Debra J. (2017). Ergodicity of non-hamiltonian equilibrium systems. Computational Methods in Science and Technology, 23 (3), 175-184. doi: 10.12921/cmst.2016.0000068 |
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2017 Journal Article Semiclathrate hydrates of methane + tetraalkylammonium hydroxidesSu, Yuan, Searles, Debra J. and Wang, Liguang (2017). Semiclathrate hydrates of methane + tetraalkylammonium hydroxides. Fuel, 203, 618-626. doi: 10.1016/j.fuel.2017.05.005 |
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2017 Journal Article PFPE-Based Polymeric 19F MRI Agents: A New Class of Contrast Agents with Outstanding SensitivityZhang, Cheng, Moonshi, Shehzahdi Shebbrin, Han, Yanxiao, Puttick, Simon, Peng, Hui, Magoling, Bryan John Abel, Reid, James C., Bernardi, Stefano, Searles, Debra J., Král, Petr and Whittaker, Andrew K. (2017). PFPE-Based Polymeric 19F MRI Agents: A New Class of Contrast Agents with Outstanding Sensitivity. Macromolecules, 50 (15), 5953-5963. doi: 10.1021/acs.macromol.7b01285 |
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2017 Journal Article Graphenylene monolayers doped with alkali or alkaline earth metals: promising materials for clean energy storageHussain, Tanveer, Hankel, Marlies and Searles, Debra J. (2017). Graphenylene monolayers doped with alkali or alkaline earth metals: promising materials for clean energy storage. Journal of Physical Chemistry C, 121 (27), 14393-14400. doi: 10.1021/acs.jpcc.7b02191 |
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2017 Journal Article Biphenylene and phagraphene as lithium ion battery anode materialsFerguson, David, Searles, Debra J. and Hankel, Marlies (2017). Biphenylene and phagraphene as lithium ion battery anode materials. ACS Applied Materials & Interfaces, 9 (24), 20577-20584. doi: 10.1021/acsami.7b04170 |
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2017 Journal Article Gasification of diosgenin solid waste for hydrogen production in supercritical waterCao, Wen, Cao, Changqing, Guo, Liejin, Jin, Hui, Dargusch, Matthew, Bernhardt, Debra and Yao, Xiangdong (2017). Gasification of diosgenin solid waste for hydrogen production in supercritical water. International Journal of Hydrogen Energy, 42 (15), 9448-9457. doi: 10.1016/j.ijhydene.2017.03.115 |
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2017 Conference Publication PFPE-based polymeric 19F MRI agents: A new class of contrast agents with outstanding sensitivityZhang, Cheng, Peng, Hui, Puttick, Simon, Searles, Debra and Whittaker, Andrew (2017). PFPE-based polymeric 19F MRI agents: A new class of contrast agents with outstanding sensitivity. 253rd National Meeting of the American-Chemical-Society (ACS) on Advanced Materials, Technologies, Systems, and Processes, San Francisco Ca, Apr 02-06, 2017. WASHINGTON: AMER CHEMICAL SOC. |
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2017 Journal Article Sodium-intercalated bulk graphdiyne as an anode material for rechargeable batteriesFarokh Niaei, Amir H., Hussain, Tanveer, Hankel, Marlies and Searles, Debra J. (2017). Sodium-intercalated bulk graphdiyne as an anode material for rechargeable batteries. Journal of Power Sources, 343, 354-363. doi: 10.1016/j.jpowsour.2017.01.027 |
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2017 Journal Article Switched photocurrent on tin sulfide-based nanoplate photoelectrodesChen, Hongjun, Lyu, Miaoqiang, Zhang, Meng, Feron, Krishna, Searles, Debra J., Dargusch, Matthew, Yao, Xiangdong and Wang, Lianzhou (2017). Switched photocurrent on tin sulfide-based nanoplate photoelectrodes. ChemSusChem, 10 (4), 670-674. doi: 10.1002/cssc.201601603 |
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2017 Journal Article Water structure and transport in zeolites with pores in one or three dimensions from molecular dynamics simulationsHan, Kuk Nam, Bernardi, Stefano, Wang, Lianzhou and Searles, Debra J. (2017). Water structure and transport in zeolites with pores in one or three dimensions from molecular dynamics simulations. Journal of Physical Chemistry C, 121 (1), 381-391. doi: 10.1021/acs.jpcc.6b10316 |
