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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 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 |
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2016 Journal Article Hydrogen production from supercritical water gasification of chicken manureCao, Wen, Cao, Changqing, Guo, Liejin, Jin, Hui, Dargusch, Matthew, Bernhardt, Debra and Yao, Xiangdong (2016). Hydrogen production from supercritical water gasification of chicken manure. International Journal of Hydrogen Energy, 41 (48), 22722-22731. doi: 10.1016/j.ijhydene.2016.09.031 |
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2016 Journal Article A derivation of the gibbs equation and the determination of change in gibbs entropy from calorimetryEvans, Denis J., Searles, Debra J. and Williams, Stephen R. (2016). A derivation of the gibbs equation and the determination of change in gibbs entropy from calorimetry. Australian Journal of Chemistry, 69 (12), 1413-1419. doi: 10.1071/CH16447 |
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2016 Journal Article Equilibrium binding energies from fluctuation theorems and force spectroscopy simulationsHodges, Emma, Cooke, B. M., Sevick E.M., Searles, Debra J., Dunweg, B. and Prakash, J. Ravi (2016). Equilibrium binding energies from fluctuation theorems and force spectroscopy simulations. Soft Matter, 12 (48), 9803-9820. doi: 10.1039/C6SM02549H |
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2016 Journal Article Computational evaluation of lithium-functionalized carbon nitride (g-C6N8) monolayer as an efficient hydrogen storage materialHussain, Tanveer, Hankel, Marlies and Searles, Debra J. (2016). Computational evaluation of lithium-functionalized carbon nitride (g-C6N8) monolayer as an efficient hydrogen storage material. Journal of Physical Chemistry C, 120 (44), 25180-25188. doi: 10.1021/acs.jpcc.6b06182 |
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2016 Journal Article On typicality in nonequilibrium steady statesEvans, Denis J., Williams, Stephen R., Searles, Debra J. and Rondoni, Lamberto (2016). On typicality in nonequilibrium steady states. Journal of Statistical Physics, 164 (4), 842-857. doi: 10.1007/s10955-016-1563-3 |
