Squeezout phenomena and boundary layer formation of a model ionic liquid under confinement and charging (English)
- New search for: Capozza, R
- New search for: Capozza, R
- New search for: Vanossi, A
- New search for: Benassi, A
- New search for: Tosatti, E
In:
The journal of chemical physics
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142
, 6
;
2015
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ISSN:
- Article (Journal) / Print
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Title:Squeezout phenomena and boundary layer formation of a model ionic liquid under confinement and charging
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Contributors:
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Published in:The journal of chemical physics ; 142, 6
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Publisher:
- New search for: AIP
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Place of publication:Melville, NY
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Publication date:2015
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ISSN:
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ZDBID:
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DOI:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 35.10
- Further information on Basic classification
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Keywords:
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Classification:
BKL: 35.10 Physikalische Chemie: Allgemeines -
Source:
Table of contents – Volume 142, Issue 6
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
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State-to-state reaction dynamics of 18O+32O2 studied by a time-dependent quantum wavepacket methodXie, Wenbo / Liu, Lan / Sun, Zhigang / Guo, Hua / Dawes, Richard et al. | 2015
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The charge-asymmetric nonlocally determined local-electric (CANDLE) solvation modelSundararaman, Ravishankar / Goddard, William A. et al. | 2015
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Order and disorder in irreversible decay processesNichols, Jonathan W. / Flynn, Shane W. / Green, Jason R. et al. | 2015
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The fundamental rotational interval of para-H by MQDT-assisted Rydberg spectroscopy of H2Haase, Christa / Beyer, Maximilian / Jungen, Christian / Merkt, Frédéric et al. | 2015
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Relativistic effects for the reaction Sg + 6 CO → Sg(CO)6: Prediction of the mean bond energy, atomization energy, and existence of the first organometallic transactinide superheavy hexacarbonyl Sg(CO)6Malli, Gulzari L. et al. | 2015
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Experimental and theoretical investigation of the first-order hyperpolarizability of a class of triarylamine derivativesSilva, Daniel L. / Fonseca, Ruben D. / Vivas, Marcelo G. / Ishow, E. / Canuto, Sylvio / Mendonca, Cleber R. / De Boni, Leonardo et al. | 2015
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Short-time diffusion in concentrated bidisperse hard-sphere suspensionsWang, Mu / Heinen, Marco / Brady, John F. et al. | 2015
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Evaluation of finite-size effects in cavitation and droplet formationWilhelmsen, Øivind / Reguera, David et al. | 2015
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Squeezout phenomena and boundary layer formation of a model ionic liquid under confinement and chargingCapozza, R. / Vanossi, A. / Benassi, A. / Tosatti, E. et al. | 2015
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Dynamic correlation length scales under isochronal conditionsCasalini, R. / Fragiadakis, D. / Roland, C. M. et al. | 2015
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An auxiliary-field quantum Monte Carlo study of the chromium dimerPurwanto, Wirawan / Zhang, Shiwei / Krakauer, Henry et al. | 2015
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Relaxation processes in a lower disorder order transition diblock copolymerSanz, Alejandro / Ezquerra, Tiberio A. / Hernández, Rebeca / Sprung, Michael / Nogales, Aurora et al. | 2015
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First-order derivative couplings between excited states from adiabatic TDDFT response theoryOu, Qi / Bellchambers, Gregory D. / Furche, Filipp / Subotnik, Joseph E. et al. | 2015
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Photoelectron spectra of CeO− and Ce(OH)2−Ray, Manisha / Felton, Jeremy A. / Kafader, Jared O. / Topolski, Josey E. / Jarrold, Caroline Chick et al. | 2015
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Dissociative electron attachments to ethanol and acetaldehyde: A combined experimental and simulation studyWang, Xu-Dong / Xuan, Chuan-Jin / Feng, Wen-Ling / Tian, Shan Xi et al. | 2015
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Lithium formate ion clusters formation during electrospray ionization: Evidence of magic number clusters by mass spectrometry and ab initio calculationsShukla, Anil / Bogdanov, Bogdan et al. | 2015
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A full-dimensional quantum dynamics study of the mode specificity in the H + HOD abstraction reactionFu, Bina / Zhang, Dong H. et al. | 2015
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A molecular symmetry analysis of the electronic states and transition dipole moments for molecules with two torsional degrees of freedomObaid, R. / Leibscher, M. et al. | 2015
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Simultaneous analysis of the Ballik-Ramsay and Phillips systems of C2 and observation of forbidden transitions between singlet and triplet statesChen, Wang / Kawaguchi, Kentarou / Bernath, Peter F. / Tang, Jian et al. | 2015
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Nuclear quantum effects on the high pressure melting of dense lithiumFeng, Yexin / Chen, Ji / Alfè, Dario / Li, Xin-Zheng / Wang, Enge et al. | 2015
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Nonlinear ion transport in the supercooled ionic liquid 1-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide: Frequency dependence of third-order and fifth-order conductivity coefficientsPatro, L. N. / Burghaus, O. / Roling, B. et al. | 2015
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Effects of polarizability on the structural and thermodynamics properties of [Cnmim][Gly] ionic liquids (n = 1–4) using EEM/MM molecular dynamic simulationsWu, Yang / Hu, Na / Yue, Lili / Wei, Lihong / Guan, Wei et al. | 2015
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Statistical mechanics of Hamiltonian adaptive resolution simulationsEspañol, P. / Delgado-Buscalioni, R. / Everaers, R. / Potestio, R. / Donadio, D. / Kremer, K. et al. | 2015
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Analytic derivative couplings in time-dependent density functional theory: Quadratic response theory versus pseudo-wavefunction approachZhang, Xing / Herbert, John M. et al. | 2015
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Caveats of mean first-passage time methods applied to the crystallization transition: Effects of non-MarkovianityJungblut, Swetlana / Dellago, Christoph et al. | 2015
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Two-photon absorption cross sections within equation-of-motion coupled-cluster formalism using resolution-of-the-identity and Cholesky decomposition representations: Theory, implementation, and benchmarksNanda, Kaushik D. / Krylov, Anna I. et al. | 2015
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Evidence for weakly bound electrons in non-irradiated alkane crystals: The electrons as a probe of structural differences in crystalsPietrow, M. / Gagoś, M. / Misiak, L. E. / Kornarzyński, K. / Szurkowski, J. / Rochowski, P. / Grzegorczyk, M. et al. | 2015
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Isotropic-nematic phase equilibria of hard-sphere chain fluids—Pure components and binary mixturesOyarzún, Bernardo / van Westen, Thijs / Vlugt, Thijs J. H. et al. | 2015
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Third order dielectric time dependent susceptibilities and the “box model”Pick, R. M. et al. | 2015
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Accuracy of buffered-force QM/MM simulations of silicaPeguiron, Anke / Colombi Ciacchi, Lucio / De Vita, Alessandro / Kermode, James R. / Moras, Gianpietro et al. | 2015
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Tolman length and rigidity constants of the Lennard-Jones fluidWilhelmsen, Øivind / Bedeaux, Dick / Reguera, David et al. | 2015
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Erratum: “Effect of the asymmetry of the coupling of the redox molecule to the electrodes in the one-level electrochemical bridged tunneling contact on the Coulomb blockade and the operation of molecular transistor” [J. Chem. Phys. 141, 124706 (2014)]Medvedev, Igor G. et al. | 2015
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Asynchronous symmetry-based sequences for homonuclear dipolar recoupling in solid-state nuclear magnetic resonanceTan, Kong Ooi / Rajeswari, M. / Madhu, P. K. / Ernst, Matthias et al. | 2015
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Model space diabatization for quantum photochemistryLi, Shaohong L. / Truhlar, Donald G. / Schmidt, Michael W. / Gordon, Mark S. et al. | 2015
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Cross-polarization phenomena in the NMR of fast spinning solids subject to adiabatic sweepsWi, Sungsool / Gan, Zhehong / Schurko, Robert / Frydman, Lucio et al. | 2015
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Bloch-Redfield equations for modeling light-harvesting complexesJeske, Jan / Ing, David J. / Plenio, Martin B. / Huelga, Susana F. / Cole, Jared H. et al. | 2015
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Symmetry breaking and excitonic effects on optical properties of defective nanographenesNoguchi, Yoshifumi / Sugino, Osamu et al. | 2015
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The relationship between reorientational molecular motions and phase transitions in [Mg(H2O)6](BF4)2, studied with the use of 1H and 19F NMR and FT-MIRMikuli, Edward / Hetmańczyk, Joanna / Grad, Bartłomiej / Kozak, Asja / Wąsicki, Jan W. / Bilski, Paweł / Hołderna-Natkaniec, Krystyna / Medycki, Wojciech et al. | 2015
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Structural evolution during fragile-to-strong transition in CuZr(Al) glass-forming liquidsZhou, Chao / Hu, Lina / Sun, Qijing / Zheng, Haijiao / Zhang, Chunzhi / Yue, Yuanzheng et al. | 2015
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Erratum: “Restricted active space calculations of L-edge X-ray absorption spectra: From molecular orbitals to multiplet states” [J. Chem. Phys. 141, 124116 (2014)]Pinjari, Rahul V. / Delcey, Mickaël G. / Guo, Meiyuan / Odelius, Michael / Lundberg, Marcus et al. | 2015
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Non-orthogonal spin-adaptation of coupled cluster methods: A new implementation of methods including quadruple excitationsMatthews, Devin A. / Stanton, John F. et al. | 2015
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Electronic excitation of carbonyl sulphide (COS) by high-resolution vacuum ultraviolet photoabsorption and electron-impact spectroscopy in the energy region from 4 to 11 eVLimão-Vieira, P. / Ferreira da Silva, F. / Almeida, D. / Hoshino, M. / Tanaka, H. / Mogi, D. / Tanioka, T. / Mason, N. J. / Hoffmann, S. V. / Hubin-Franskin, M.-J. et al. | 2015
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Distribution of distances between DNA barcode labels in nanochannels close to the persistence lengthReinhart, Wesley F. / Reifenberger, Jeff G. / Gupta, Damini / Muralidhar, Abhiram / Sheats, Julian / Cao, Han / Dorfman, Kevin D. et al. | 2015
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Communication: Surface-to-bulk diffusion of isolated versus interacting C atoms in Ni(111) and Cu(111) substrates: A first principle investigationHarpale, Abhilash / Panesi, Marco / Chew, Huck Beng et al. | 2015
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Stochastic linear multistep methods for the simulation of chemical kineticsBarrio, Manuel / Burrage, Kevin / Burrage, Pamela et al. | 2015
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Full-dimensional and reduced-dimensional calculations of initial state-selected reaction probabilities studying the H + CH4 → H2 + CH3 reaction on a neural network PESWelsch, Ralph / Manthe, Uwe et al. | 2015
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Nuclear quantum effects in water exchange around lithium and fluoride ionsWilkins, David M. / Manolopoulos, David E. / Dang, Liem X. et al. | 2015
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How the flow affects the phase behaviour and microstructure of polymer nanocompositesStephanou, Pavlos S. et al. | 2015
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Accurate thermochemistry from explicitly correlated distinguishable cluster approximationKats, Daniel / Kreplin, David / Werner, Hans-Joachim / Manby, Frederick R. et al. | 2015
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Ab initio dynamics of the cytochrome P450 hydroxylation reactionElenewski, Justin E. / Hackett, John C et al. | 2015
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Does DFT-SAPT method provide spectroscopic accuracy?Shirkov, Leonid / Makarewicz, Jan et al. | 2015
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Comparison of the local binding motifs in the imidazolium-based ionic liquids [EMIM][BF4] and [EMMIM][BF4] through cryogenic ion vibrational predissociation spectroscopy: Unraveling the roles of anharmonicity and intermolecular interactionsFournier, Joseph A. / Wolke, Conrad T. / Johnson, Christopher J. / McCoy, Anne B. / Johnson, Mark A. et al. | 2015
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Ab initio atomistic thermodynamics study on the oxidation mechanism of binary and ternary alloy surfacesLiu, Shi-Yu / Liu, Shiyang / Li, De-Jun / Wang, Sanwu / Guo, Jing / Shen, Yaogen et al. | 2015
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Hydrophobic hydration and the anomalous partial molar volumes in ethanol-water mixturesTan, Ming-Liang / Miller, Benjamin T. / Te, Jerez / Cendagorta, Joseph R. / Brooks, Bernard R. / Ichiye, Toshiko et al. | 2015
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On the feasibility of silicene encapsulation by AlN deposited using an atomic layer deposition processVan Bui, H. / Wiggers, F. B. / Friedlein, R. / Yamada-Takamura, Y. / Kovalgin, A. Y. / de Jong, M. P. et al. | 2015
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Crystallization in supercooled liquid Cu: Homogeneous nucleation and growthE, J. C. / Wang, L. / Cai, Y. / Wu, H. A. / Luo, S. N. et al. | 2015
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Fermi orbital derivatives in self-interaction corrected density functional theory: Applications to closed shell atomsPederson, Mark R. et al. | 2015
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Correlated electron pseudopotentials for 3d-transition metalsTrail, J. R. / Needs, R. J. et al. | 2015
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On the covariant description of diffusion in two-dimensional confined environmentsGarcía-Chung, Angel A. / Chacón-Acosta, Guillermo / Dagdug, Leonardo et al. | 2015
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Interaction of ions, atoms, and small molecules with quantized vortex lines in superfluid 4HeMateo, David / Eloranta, Jussi / Williams, Gary A. et al. | 2015
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Maximum probability domains for the analysis of the microscopic structure of liquidsAgostini, Federica / Ciccotti, Giovanni / Savin, Andreas / Vuilleumier, Rodolphe et al. | 2015
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A scale-bridging modeling approach for anisotropic organic molecules at patterned semiconductor surfacesKleppmann, Nicola / Klapp, Sabine H. L. et al. | 2015
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The growth of sulfur adlayers on Au(100)Jiang, Yue / Liang, Xihui / Ren, Shendong / Chen, Chi-Lu / Fan, Liang-Jen / Yang, Yaw-Wen / Tang, Jian-Ming / Luh, Dah-An et al. | 2015
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Extended Lagrangian Born-Oppenheimer molecular dynamics simulations of the shock-induced chemistry of phenylacetyleneCawkwell, M. J. / Niklasson, Anders M. N. / Dattelbaum, Dana M. et al. | 2015
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Alkali metal mediated C–C bond coupling reactionTachikawa, Hiroto et al. | 2015