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Material Type: Artigo
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Pore-Space-Partition-Enabled Exceptional Ethane Uptake and Ethane-Selective Ethane–Ethylene SeparationYang, Huajun ; Wang, Yanxiang ; Krishna, Rajamani ; Jia, Xiaoxia ; Wang, Yong ; Hong, Anh N ; Dang, Candy ; Castillo, Henry E ; Bu, Xianhui ; Feng, PingyunJournal of the American Chemical Society, 2020-02, Vol.142 (5), p.2222-2227 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Calcium ions in aqueous solutions: Accurate force field description aided by ab initio molecular dynamics and neutron scatteringMartinek, Tomas ; Duboué-Dijon, Elise ; Timr, Štěpán ; Mason, Philip E. ; Baxová, Katarina ; Fischer, Henry E. ; Schmidt, Burkhard ; Pluhařová, Eva ; Jungwirth, PavelThe Journal of chemical physics, 2018-06, Vol.148 (22), p.222813-222813 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Hydration and Ion Pairing in Aqueous Mg2+ and Zn2+ Solutions: Force-Field Description Aided by Neutron Scattering Experiments and Ab Initio Molecular Dynamics SimulationsDuboué-Dijon, Elise ; Mason, Philip E ; Fischer, Henry E ; Jungwirth, PavelThe journal of physical chemistry. B, 2018-04, Vol.122 (13), p.3296-3306 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Temperature-dependent anisotropy in the bond lengths of UO2 as a result of phonon-induced atomic correlationsDesgranges, Lionel ; Baldinozzi, Gianguido ; Fischer, Henry E ; Lander, Gerard HJournal of physics. Condensed matter, 2023-03, Vol.35 (10) [Periódico revisado por pares]IOP PublishingTexto completo disponível |
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Material Type: Artigo
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From SmOF to SmH0.78OF0.22: H/F Substitution in Oxide Fluorides as a Synthesis Route to Heteroanionic CompoundsZapp, Nicolas ; Fischer, Henry E ; Kohlmann, HolgerInorganic chemistry, 2021-12, Vol.60 (23), p.17775-17782 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Bound state energies and critical bound region in the semiclassical dense hydrogen plasmasYan, Tong ; Jiao, Li Guang ; Liu, Aihua ; Wang, Yuan Cheng ; Montgomery, Henry E. ; Ho, Yew Kam ; Fritzsche, StephanPhysics of plasmas, 2024-04, Vol.31 (4) [Periódico revisado por pares]Melville: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Resonances in the Hulthén potential: benchmark calculations, critical behaviors, and interference effectsHu, Zi Xi ; Jiao, Li Guang ; Liu, Aihua ; Wang, Yuan Cheng ; Montgomery Jr, Henry E ; Ho, Yew Kam ; Fritzsche, StephanJournal of physics. A, Mathematical and theoretical, 2023-11, Vol.56 (44), p.445301 [Periódico revisado por pares]IOP PublishingTexto completo disponível |
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Material Type: Artigo
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Design and Control of Perylene Supramolecular Polymers through Imide SubstitutionsWilson‐Kovacs, Robert S. ; Fang, Xue ; Hagemann, Maximilian J. L. ; Symons, Henry E. ; Faul, Charl F. J.Chemistry : a European journal, 2022-01, Vol.28 (3), p.e202103443-n/a [Periódico revisado por pares]Germany: Wiley Subscription Services, IncTexto completo disponível |
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Material Type: Artigo
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Structure of molten NaCl and the decay of the pair-correlationsZeidler, Anita ; Salmon, Philip S. ; Usuki, Takeshi ; Kohara, Shinji ; Fischer, Henry E. ; Wilson, MarkThe Journal of chemical physics, 2022-09, Vol.157 (9), p.094504-094504 [Periódico revisado por pares]Melville: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Structure of Strontium Aluminosilicate Glasses from Molecular Dynamics Simulation, Neutron Diffraction, and Nuclear Magnetic Resonance StudiesCharpentier, Thibault ; Okhotnikov, Kirill ; Novikov, Alexey N ; Hennet, Louis ; Fischer, Henry E ; Neuville, Daniel R ; Florian, PierreThe journal of physical chemistry. B, 2018-10, Vol.122 (41), p.9567-9583 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |