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Dipole-bound excited states and resonant photoelectron imaging of phenoxide and thiophenoxide anions
The activation energy for water reorientation differs between IR pump-probe and NMR measurements
Asymmetric electrolytes near structured dielectric interfaces
Hydrogen adsorption on Pt(111) revisited from random phase approximation
The influence of metal cluster lattices on the screening of image potential state electrons on graphene
A HR-XPS study of the formation of h-BN on Ni(111) from the two precursors, ammonia borane and borazine
An extended chiral surface coordination network based on Ag7-clusters
Uniaxial-deformation behavior of ice Ih as described by the TIP4P/Ice and mW water models
COMMUNICATIONS
Communication: A comparison between the solution properties of knotted ring and star polymers
J. Chem. Phys. 149, 161101 (2018)
https://doi.org/10.1063/1.5048937
SPECIAL TOPIC: CHEMICAL PHYSICS OF CHARGED MACROMOLECULES
Preface
Preface: Special Topic on Chemical Physics of Charged Macromolecules
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163001 (2018)
https://doi.org/10.1063/1.5064594
Articles
Small-angle scattering study of tetra-poly(acrylic acid) gels
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163301 (2018)
https://doi.org/10.1063/1.5027665
From octopus to dendrite—Semiflexible polyelectrolyte brush condensates in trivalent counterion solution
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163302 (2018)
https://doi.org/10.1063/1.5027161
Polyelectrolyte complex coacervation: Effects of concentration asymmetry
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163303 (2018)
https://doi.org/10.1063/1.5028524
Binding of trivalent ions on fatty acid Langmuir monolayer: Fe3+ versus La3+
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163304 (2018)
https://doi.org/10.1063/1.5028296
Polyelectrolyte association and solvation
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163305 (2018)
https://doi.org/10.1063/1.5030530
Single molecule electrophoresis of star polymers through nanopores: Simulations
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163306 (2018)
https://doi.org/10.1063/1.5029980
Anomalous multipole expansion: Charge regulation of patchy inhomogeneously charged spherical particles
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163307 (2018)
https://doi.org/10.1063/1.5037044
Polyelectrolyte complex coacervation by electrostatic dipolar interactions
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163308 (2018)
https://doi.org/10.1063/1.5029268
Effect of calcium ions on the interactions between surfaces end-grafted with weak polyelectrolytes
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163309 (2018)
https://doi.org/10.1063/1.5029377
Effect of temperature on the structure and dynamics of triblock polyelectrolyte gels
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163310 (2018)
https://doi.org/10.1063/1.5035083
Promoting single-file DNA translocations through nanopores using electro-osmotic flow
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163311 (2018)
https://doi.org/10.1063/1.5031010
Ionic effects in semi-dilute biopolymer solutions: A small angle scattering study
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163312 (2018)
https://doi.org/10.1063/1.5028351
Impact of ion content and electric field on mechanical properties of coarse-grained ionomers
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163313 (2018)
https://doi.org/10.1063/1.5029260
Site-specific perspective on interactions in polyelectrolyte complexes: Toward quantitative understanding
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163314 (2018)
https://doi.org/10.1063/1.5035567
Interfacial properties of polymeric complex coacervates from simulation and theory
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163315 (2018)
https://doi.org/10.1063/1.5029934
Individual circular polyelectrolytes under shear flow
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163316 (2018)
https://doi.org/10.1063/1.5028406
Comparison of KBr and NaCl effects on the glass transition temperature of hydrated layer-by-layer assemblies
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163317 (2018)
https://doi.org/10.1063/1.5037491
Polyacrylates in the presence of an extraordinary monovalent cation—Solution behavior and metal nanoparticle formation
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163318 (2018)
https://doi.org/10.1063/1.5028182
A polarizable MARTINI model for monovalent ions in aqueous solution
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163319 (2018)
https://doi.org/10.1063/1.5028354
Anomalous viscosity-time behavior of polysaccharide dispersions
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163320 (2018)
https://doi.org/10.1063/1.5027720
The so-called critical condition for polyelectrolyte-colloid complex formation
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163321 (2018)
https://doi.org/10.1063/1.5029296
Gold nanoparticle distribution in polyelectrolyte brushes loaded at different pH conditions
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163322 (2018)
https://doi.org/10.1063/1.5035554
Charge fluctuation effects on the shape of flexible polyampholytes with applications to intrinsically disordered proteins
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163323 (2018)
https://doi.org/10.1063/1.5035428
Interaction of human serum albumin with dendritic polyglycerol sulfate: Rationalizing the thermodynamics of binding
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163324 (2018)
https://doi.org/10.1063/1.5030601
Swelling of individual nanodomains in hydrated block copolymer electrolyte membranes
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163325 (2018)
https://doi.org/10.1063/1.5029452
Protein encapsulation via polyelectrolyte complex coacervation: Protection against protein denaturation
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163326 (2018)
https://doi.org/10.1063/1.5040346
Deformation of contacting interface between polymer hydrogel and silica sphere studied by resonance shear measurement
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163327 (2018)
https://doi.org/10.1063/1.5037326
The effect of chain stiffness and salt on the elastic response of a polyelectrolyte
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163328 (2018)
https://doi.org/10.1063/1.5035340
Molecular weight dependence of chain conformation of strong polyelectrolytes
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163329 (2018)
https://doi.org/10.1063/1.5035458
Non-equilibrium phenomena and kinetic pathways in self-assembled polyelectrolyte complexes
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163330 (2018)
https://doi.org/10.1063/1.5039621
DNA molecules deviate from shortest trajectory when driven through hydrogel
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163331 (2018)
https://doi.org/10.1063/1.5033990
Dielectric virial expansion of polarizable dipolar spheres
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163332 (2018)
https://doi.org/10.1063/1.5035551
Electrostatic effects in collagen fibril formation
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163333 (2018)
https://doi.org/10.1063/1.5036526
Understanding the effects of symmetric salt on the structure of a planar dipolar polymer brush
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163334 (2018)
https://doi.org/10.1063/1.5037077
Role of electrostatic correlations in polyelectrolyte charge association
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163335 (2018)
https://doi.org/10.1063/1.5034454
Enhanced scattering induced by electrostatic correlations in concentrated solutions of salt-free dipolar and ionic polymers
In Special Collection:
Chemical Physics of Charged Macromolecules
J. Chem. Phys. 149, 163336 (2018)
https://doi.org/10.1063/1.5044637
ARTICLES
Theoretical Methods and Algorithms
Fermi-Löwdin orbital self-interaction correction to magnetic exchange couplings
J. Chem. Phys. 149, 164101 (2018)
https://doi.org/10.1063/1.5050809
Auxiliary-field quantum Monte Carlo calculations of the structural properties of nickel oxide
J. Chem. Phys. 149, 164102 (2018)
https://doi.org/10.1063/1.5040900
Generalized Kohn–Sham iteration on Banach spaces
J. Chem. Phys. 149, 164103 (2018)
https://doi.org/10.1063/1.5037790
Waiting time between charging and discharging processes in molecular junctions
J. Chem. Phys. 149, 164105 (2018)
https://doi.org/10.1063/1.5049770
Projected coupled cluster theory: Optimization of cluster amplitudes in the presence of symmetry projection
J. Chem. Phys. 149, 164108 (2018)
https://doi.org/10.1063/1.5053605
Rigorous use of symmetry within the construction of multidimensional potential energy surfaces
J. Chem. Phys. 149, 164110 (2018)
https://doi.org/10.1063/1.5047912
Oscillations in the mean transition time of a particle scattered on a double slit potential
J. Chem. Phys. 149, 164114 (2018)
https://doi.org/10.1063/1.5051800
One-particle density matrix polarization susceptibility tensors
J. Chem. Phys. 149, 164115 (2018)
https://doi.org/10.1063/1.5051995
Advanced Experimental Techniques
A magnetically focused molecular beam source for deposition of spin-polarised molecular surface layers
J. Chem. Phys. 149, 164201 (2018)
https://doi.org/10.1063/1.5048521
Atoms, Molecules, and Clusters
Dipole-bound excited states and resonant photoelectron imaging of phenoxide and thiophenoxide anions
J. Chem. Phys. 149, 164301 (2018)
https://doi.org/10.1063/1.5049715
Spectroscopy of the electronic excited states of thioxophosphane, HPS, and of its deuterated species
J. Chem. Phys. 149, 164303 (2018)
https://doi.org/10.1063/1.5048463
Microwave spectrum and non-covalent interactions of the 1, 2, 3, 4-tetrafluorobenzene-water complex
J. Chem. Phys. 149, 164306 (2018)
https://doi.org/10.1063/1.5048101
Low-energy electron-induced decomposition of 5-trifluoromethanesulfonyl-uracil: A potential radiosensitizer
J. Chem. Phys. 149, 164307 (2018)
https://doi.org/10.1063/1.5050594
Liquids, Glasses, and Crystals
Which probes can report intrinsic dynamic heterogeneity of a glass forming liquid?
J. Chem. Phys. 149, 164501 (2018)
https://doi.org/10.1063/1.5047215
Nucleation instability in supercooled Cu–Zr–Al glass-forming liquids
J. Chem. Phys. 149, 164502 (2018)
https://doi.org/10.1063/1.5054631
The activation energy for water reorientation differs between IR pump-probe and NMR measurements
J. Chem. Phys. 149, 164504 (2018)
https://doi.org/10.1063/1.5050203
Describing screening in dense ionic fluids with a charge-frustrated Ising model
In Special Collection:
JCP Editors' Choice 2018
J. Chem. Phys. 149, 164505 (2018)
https://doi.org/10.1063/1.5043410
Surfaces, Interfaces, and Materials
Asymmetric electrolytes near structured dielectric interfaces
J. Chem. Phys. 149, 164701 (2018)
https://doi.org/10.1063/1.5047550
Hydrogen adsorption on Pt(111) revisited from random phase approximation
J. Chem. Phys. 149, 164702 (2018)
https://doi.org/10.1063/1.5050830
Impact of iodine antisite (IPb) defects on the electronic properties of the (110) CH3NH3PbI3 surface
J. Chem. Phys. 149, 164704 (2018)
https://doi.org/10.1063/1.5044667
The influence of metal cluster lattices on the screening of image potential state electrons on graphene
J. Chem. Phys. 149, 164706 (2018)
https://doi.org/10.1063/1.5052643
Delicate interactions of PTCDI molecules on Ag/Si(111)-
J. Chem. Phys. 149, 164707 (2018)
https://doi.org/10.1063/1.5053606
Humidity effect on ion behaviors of moisture-driven CO2 sorbents
J. Chem. Phys. 149, 164708 (2018)
https://doi.org/10.1063/1.5027105
A HR-XPS study of the formation of h-BN on Ni(111) from the two precursors, ammonia borane and borazine
J. Chem. Phys. 149, 164709 (2018)
https://doi.org/10.1063/1.5051595
An extended chiral surface coordination network based on Ag7-clusters
J. Chem. Phys. 149, 164710 (2018)
https://doi.org/10.1063/1.5051510
Uniaxial-deformation behavior of ice Ih as described by the TIP4P/Ice and mW water models
J. Chem. Phys. 149, 164711 (2018)
https://doi.org/10.1063/1.5048517
Polymers and Soft Matter
Near-surface structure of Nafion in deuterated water
In Special Collection:
JCP Editors' Choice 2018
J. Chem. Phys. 149, 164901 (2018)
https://doi.org/10.1063/1.5042065
Giant negative mobility of inertial particles caused by the periodic potential in steady laminar flows
J. Chem. Phys. 149, 164903 (2018)
https://doi.org/10.1063/1.5048319
Charged solitons in branched conducting polymers
J. Chem. Phys. 149, 164908 (2018)
https://doi.org/10.1063/1.5052044
Deeper penetration of surface effects on particle mobility than on hopping rate in glassy polymer films
J. Chem. Phys. 149, 164909 (2018)
https://doi.org/10.1063/1.5052659
Segmental dynamics of polymer by rotational fluorescence correlation microscopy
J. Chem. Phys. 149, 164910 (2018)
https://doi.org/10.1063/1.5050634
Properties of Rouse polymers with actively driven regions
J. Chem. Phys. 149, 164911 (2018)
https://doi.org/10.1063/1.5045686
Biological Molecules and Networks
Stretching of single DNA molecules caused by accelerating flow on a microchip
J. Chem. Phys. 149, 165101 (2018)
https://doi.org/10.1063/1.5040564
