Phase behavior of a two-dimensional and confined in slitlike pores square-shoulder, square-well fluid (English)
- New search for: Rzysko, W.
- New search for: Rzysko, W.
- New search for: Patrykiejew, A.
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In:
The journal of chemical physics
;
132
, 16
; 164702-164703
;
2010
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ISSN:
- Article (Journal) / Print
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Title:Phase behavior of a two-dimensional and confined in slitlike pores square-shoulder, square-well fluid
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Contributors:
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Published in:The journal of chemical physics ; 132, 16 ; 164702-164703
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Publisher:
- New search for: AIP
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Place of publication:Melville, NY
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Publication date:2010
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ISSN:
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ZDBID:
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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 132, Issue 16
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.
- 161101
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Communications: The electronic spectrum of Li(NH3)4Varriale, Luigi / Tonge, Nicola M. / Bhalla, Nitika / Ellis, Andrew M. et al. | 2010
- 161102
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Communications: When diffraction rules the stereodynamics of rotationally inelastic collisionsLemeshko, Mikhail / Jambrina, Pablo G. / de Miranda, Marcelo P. / Friedrich, Bretislav et al. | 2010
- 161103
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Communications: Investigation of the superatomic character of Al13 via its interaction with sulfur atomsZhang, Zeng-Guang / Xu, Hong-Guang / Feng, Yuan / Zheng, Weijun et al. | 2010
- 161104
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Communications: Wall free capillarity and pendant drop removalHong, Siang-Jie / Chang, Feng-Ming / Chan, Seong Heng / Sheng, Yu-Jane / Tsao, Heng-Kwong et al. | 2010
- 164101
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Accurate frozen-density embedding potentials as a first step towards a subsystem description of covalent bondsFux, Samuel / Jacob, Christoph R. / Neugebauer, Johannes / Visscher, Lucas / Reiher, Markus et al. | 2010
- 164102
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Improving the density functional theory description of water with self-consistent polarizationMurdachaew, Garold / Mundy, Christopher J. / Schenter, Gregory K. et al. | 2010
- 164103
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A practical method to avoid zero-point leak in molecular dynamics calculations: Application to the water dimerCzako´, Ga´bor / Kaledin, Alexey L. / Bowman, Joel M. et al. | 2010
- 164104
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Structure, properties, and nature of the pyridine-XY (X, Y=F, Cl, Br) complexes: An ab initio studyWang, Zhaoxu / Zheng, Baishu / Yu, Xianyong / Li, Xiaofang / Yi, Pinggui et al. | 2010
- 164105
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Vibrational absorption spectra calculated from vibrational configuration interaction response theory using the Lanczos methodSeidler, Peter / Hansen, Mikkel Bo / Gyo˝rffy, Werner / Toffoli, Daniele / Christiansen, Ove et al. | 2010
- 164106
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The multiscale coarse-graining method. V. Isothermal-isobaric ensembleDas, Avisek / Andersen, Hans C. et al. | 2010
- 164107
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The multiscale coarse-graining method. VI. Implementation of three-body coarse-grained potentialsLarini, Luca / Lu, Lanyuan / Voth, Gregory A. et al. | 2010
- 164108
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Expectation values in two-component relativistic theoriesSeino, Junji / Uesugi, Wataru / Hada, Masahiko et al. | 2010
- 164109
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Fast stochastic simulation of biochemical reaction systems by alternative formulations of the chemical Langevin equationMe´lyku´ti, Bence / Burrage, Kevin / Zygalakis, Konstantinos C. et al. | 2010
- 164110
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Generalized valence bond wave functions in quantum Monte CarloAnderson, Amos G. / Goddard, William A. et al. | 2010
- 164111
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Partitioning of the molecular density matrix over atoms and bondsVanfleteren, Diederik / Van Neck, Dimitri / Bultinck, Patrick / Ayers, Paul W. / Waroquier, Michel et al. | 2010
- 164112
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Effect of an external field on the reversible reaction of a neutral particle and a charged particle in three dimensions. II. Excited-state reactionReigh, Shang Yik / Shin, Kook Joe / Kim, Hyojoon et al. | 2010
- 164113
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Implementation and assessment of a simple nonlocal van der Waals density functionalVydrov, Oleg A. / Van Voorhis, Troy et al. | 2010
- 164114
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Automated incremental scheme for explicitly correlated methodsFriedrich, Joachim / Tew, David P. / Klopper, Wim / Dolg, Michael et al. | 2010
- 164115
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Accurate calculation and modeling of the adiabatic connection in density functional theoryTeale, A. M. / Coriani, S. / Helgaker, T. et al. | 2010
- 164116
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Particle number and probability density functional theory and -representabilityPan, Xiao-Yin / Sahni, Viraht et al. | 2010
- 164117
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Tests of the RPBE, revPBE, τ-HCTHhyb, ωB97X-D, and MOHLYP density functional approximations and 29 others against representative databases for diverse bond energies and barrier heights in catalysisYang, Ke / Zheng, Jingjing / Zhao, Yan / Truhlar, Donald G. et al. | 2010
- 164301
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Time dependent measurements of nitrous oxide and carbon dioxide collisional relaxation processes by a frequency down-chirped quantum cascade laser: Rapid passage signals and the time dependence of collisional processesTasinato, Nicola / Hay, Kenneth G. / Langford, Nigel / Duxbury, Geoffrey / Wilson, David et al. | 2010
- 164302
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Temperature dependences of mechanisms responsible for the water-vapor continuum absorption. II. Dimers and collision-induced absorptionLeforestier, C. / Tipping, R. H. / Ma, Q. et al. | 2010
- 164303
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Diminished cage effect in solid p-H2: Infrared spectra of ClSCS, ClCS, and ClSC in an irradiated p-H2 matrix containing Cl2 and CS2Huang, Chiung-Wei / Lee, Yaw-Chang / Lee, Yuan-Pern et al. | 2010
- 164304
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Static polarizability surfaces of the van der Waals complex CH4–N2Buldakov, Mikhail A. / Cherepanov, Victor N. / Kalugina, Yulia N. / Zvereva-Loe¨te, Natalia / Boudon, Vincent et al. | 2010
- 164305
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Reactions of molybdenum and tungsten atoms with nitrous oxide in excess argon: A combined matrix infrared spectroscopic and theoretical studyJiang, Ling / Xu, Qiang et al. | 2010
- 164306
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Infrared study on hydrogen chloride complexed with alleneChevalier, Michele / Broquier, Michel / Brenner, Valerie et al. | 2010
- 164307
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An accurate first principles study of the geometric and electronic structure of B2, B2−, B3, B3−, and B3H: Ground and excited statesMiliordos, Evangelos / Mavridis, Aristides et al. | 2010
- 164308
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Spin-orbit effects on electronic delocalization. Aromaticity in a discrete square tetrapalladium sandwich complexMun˜oz-Castro, A. / Mac-Leod Carey, D. / Arratia-Pe´rez, R. et al. | 2010
- 164309
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Electronic spectra of jet-cooled isoindoline: Spectroscopic determination of energy difference between conformational isomersTanaka, Sei’ichi / Okuyama, Katsuhiko et al. | 2010
- 164310
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Relativistic Jahn–Teller effects in the quartet states of K3 and Rb3: A vibronic analysis of the 2 4E′←1 4A2′ electronic transitions based on ab initio calculationsHauser, Andreas W. / Aubo¨ck, Gerald / Callegari, Carlo / Ernst, Wolfgang E. et al. | 2010
- 164311
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Topology-energy relationships and lowest energy configurations for pentagonal dodecahedral (H2O)20X clusters, X=empty, H2O, NH3, H3O+: The importance of O-topologyAnick, David J. et al. | 2010
- 164312
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Reactions of C2(a 3∏u) with selected saturated alkanes: A temperature dependence studyHu, Renzhi / Zhang, Qun / Chen, Yang et al. | 2010
- 164313
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Crossed-beam dc slice imaging of chlorine atom reactions with pentane isomersEstillore, Armando D. / Visger, Laura M. / Suits, Arthur G. et al. | 2010
- 164501
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Kirkwood–Buff integrals for ideal solutionsPloetz, Elizabeth A. / Bentenitis, Nikolaos / Smith, Paul E. et al. | 2010
- 164502
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Solvation-induced one-dimensional polarons and electron transferUssery, G. L. / Gartstein, Yu. N. et al. | 2010
- 164503
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Evolution of the liquid-vapor coexistence of the hard-core Yukawa fluid as a function of the interaction rangeEl Mendoub, E. B. / Wax, J.-F. / Jakse, N. et al. | 2010
- 164504
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Recrystallization of picosecond laser-melted ZnO nanoparticles in a liquid: A molecular dynamics studyHu, Ming / Poulikakos, Dimos / Grigoropoulos, Costas P. / Pan, Heng et al. | 2010
- 164505
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Liquid crystal phase and waterlike anomalies in a core-softened shoulder-dumbbells systemBarros de Oliveira, Alan / Neves, Eduardo B. / Gavazzoni, Cristina / Paukowski, Juliana Z. / Netz, Paulo A. / Barbosa, Marcia C. et al. | 2010
- 164506
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Order-disorder phase transition and dissociation of hydrogen sulfide under high pressure: Ab initio molecular dynamics studyWang, Liancheng / Tian, Fubo / Feng, Wanxiang / Chen, Changbo / He, Zhi / Ma, Yanming / Cui, Tian / Liu, Bingbing / Zou, Guangtian et al. | 2010
- 164507
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Quantum effects of hydrogen atoms on the dynamical rearrangement of hydrogen-bond networks in liquid waterHyeon-Deuk, Kim / Ando, Koji et al. | 2010
- 164508
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A desorption mechanism of water following vacuum-ultraviolet irradiation on amorphous solid water at 90 KHama, Tetsuya / Yokoyama, Masaaki / Yabushita, Akihiro / Kawasaki, Masahiro / Andersson, Stefan / Western, Colin M. / Ashfold, Michael N. R. / Dixon, Richard N. / Watanabe, Naoki et al. | 2010
- 164509
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Free energy wells for small gas bubbles in soft deformable materialsGoldman, Saul et al. | 2010
- 164510
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Dielectric permittivity of room temperature ionic liquids: A relation to the polar and nonpolar domain structuresMizoshiri, Makoto / Nagao, Takena / Mizoguchi, Yuri / Yao, Makoto et al. | 2010
- 164511
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Extended orientational correlation study for molecular liquids containing distorted tetrahedral molecules: Application to methylene halidesPothoczki, Szilvia / Temleitner, La´szlo´ / Pusztai, La´szlo´ et al. | 2010
- 164512
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Luminescence spectroscopy of matrix-isolated atomic manganese: Site size and orbital occupancy dependence of crystal field splittingCollier, Martin A. / Byrne, Owen / Murray, Ciaran / McCaffrey, John G. et al. | 2010
- 164513
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Molecular dynamics simulations of ion transport through carbon nanotubes. I. Influence of geometry, ion specificity, and many-body interactionsBeu, Titus A. et al. | 2010
- 164514
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The crystal-field splitting of rovibrational Wv(0), Yv(0), and [ΔJ=10]v(0) transitions of solid parahydrogenMishra, Adya P. et al. | 2010
- 164515
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On structural features of fullerene C60 dissolved in carbon disulfide: Complementary study by small-angle neutron scattering and molecular dynamic simulationsAvdeev, M. V. / Tropin, T. V. / Bodnarchuk, I. A. / Yaradaikin, S. P. / Rosta, L. / Aksenov, V. L. / Bulavin, L. A. et al. | 2010
- 164516
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α-relaxation dynamics of orientanionally disordered mixed crystals composed of Cl-adamantane and CN-adamantaneMartinez-Garcia, J. C. / Tamarit, J. Ll. / Capaccioli, S. / Barrio, M. / Veglio, N. / Pardo, L. C. et al. | 2010
- 164517
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Exploring the discrepancies between experiment, theory, and simulation for the homogeneous gas-to-liquid nucleation of 1-pentanolNellas, Ricky B. / Keasler, Samuel J. / Siepmann, J. Ilja / Chen, Bin et al. | 2010
- 164701
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Kinetics of intermediate-mediated self-assembly in nanosized materials: A generic modelLutsko, James F. / Basios, Vasileios / Nicolis, Gre´goire / Caremans, Tom P. / Aerts, Alexander / Martens, Johan A. / Kirschhock, Christine E. A. / van Erp, Titus S. et al. | 2010
- 164702
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Phase behavior of a two-dimensional and confined in slitlike pores square-shoulder, square-well fluidRz˙ysko, W. / Patrykiejew, A. / Sokołowski, S. / Pizio, O. et al. | 2010
- 164703
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Structures of Aln, its anions and cations up to n=34: A theoretical investigationDrebov, Nedko / Ahlrichs, Reinhart et al. | 2010
- 164704
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Novel properties of boron nitride nanotubes encapsulated with Fe, Co, and Ni nanoclustersGhosh, Saurabh / Nigam, Sandeep / Das, G. P. / Majumdar, Chiranjib et al. | 2010
- 164705
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Ionic multilayers at the free surface of an ionic liquid, trioctylmethylammonium bis(nonafluorobutanesulfonyl)amide, probed by x-ray reflectivity measurementsNishi, Naoya / Yasui, Yukinori / Uruga, Tomoya / Tanida, Hajime / Yamada, Tasuku / Nakayama, Shun-ichi / Matsuoka, Hideki / Kakiuchi, Takashi et al. | 2010
- 164901
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Effect of monomer sequences on conformations of copolymers grafted on spherical nanoparticles: A Monte Carlo simulation studySeifpour, Arezou / Spicer, Philip / Nair, Nitish / Jayaraman, Arthi et al. | 2010
- 164902
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Adsorption trajectories and free-energy separatrices for colloidal particles in contact with a liquid-liquid interfacede Graaf, Joost / Dijkstra, Marjolein / van Roij, Rene´ et al. | 2010
- 164903
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Ionic effects on the electric field needed to orient dielectric lamellaePutzel, G. Garbe`s / Andelman, David / Tsori, Yoav / Schick, M. et al. | 2010
- 164904
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Polymer translocation through a nanopore: The effect of solvent conditionsKapahnke, Felix / Schmidt, Ulrich / Heermann, Dieter W. / Weiss, Matthias et al. | 2010
- 164905
-
Self-consistent field lattice model study on the phase behavior of physically associating polymer solutionsHan, Xiang-Gang / Zhang, Cheng-Xiang et al. | 2010
- 165101
-
Dewetting-induced globule-coil transitions of model polymers and possible implications high-temperature and low-pressure unfolding of proteinsSumi, Tomonari / Imazaki, Nobuyuki / Sekino, Hideo et al. | 2010
- 165102
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Spontaneous formation of polyglutamine nanotubes with molecular dynamics simulationsLaghaei, Rozita / Mousseau, Normand et al. | 2010
- 165103
-
Low molecular weight oligomers of amyloid peptides display β-barrel conformations: A replica exchange molecular dynamics study in explicit solventDe Simone, Alfonso / Derreumaux, Philippe et al. | 2010
- 165104
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Relationship between population of the fibril-prone conformation in the monomeric state and oligomer formation times of peptides: Insights from all-atom simulationsNam, Hoang Bao / Kouza, Maksim / Zung, Hoang / Li, Mai Suan et al. | 2010
- 166101
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Mobility in periodic channels formed by cylindrical cavitiesMarchesoni, Fabio et al. | 2010
- 169901
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Erratum: “Quantum Monte Carlo calculations of the potential energy curve of the helium dimer” [J. Chem. Phys. 128, 114308 (2008)]Springall, R. / Per, M. C. / Russo, S. P. / Snook, I. K. et al. | 2010
- 169902
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Publisher’s Note: “Comment on ‘Preserving the Boltzmann ensemble in replica-exchange molecular dynamics’ [J. Chem. Phys. 129, 164112 (2008)]” [J. Chem. Phys. 132, 127101 (2010)]Fukuda, Ikuo et al. | 2010
- 169903
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Erratum: “A new approach to evaluate the thermodiffusion factor for associating mixtures” [J. Chem. Phys. 130, 064506 (2009)]Abbasi, Alireza / Saghir, M. Ziad / Kawaji, Masahiro et al. | 2010
- 169904
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Erratum: “Relationship between thermodynamics and dynamics of supercooled liquids” [J. Chem. Phys. 125, 076102 (2006)]Mittal, Jeetain / Errington, Jeffrey R. / Truskett, Thomas M. et al. | 2010