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The Asakura–Oosawa theory: Entropic forces in physics, biology, and soft matter
Oxygen NMR of high-density and low-density amorphous ice
Confinement effects on glass-forming mixtures: Insights from a combined experimental approach to aqueous ethylene glycol solutions in silica pores
Hydrogen-bonding and nuclear quantum effects in clays
Microscopic structural origin behind slowing down of colloidal phase separation approaching gelation
EDITORIALS
The Asakura–Oosawa theory: Entropic forces in physics, biology, and soft matter
J. Chem. Phys. 156, 080401 (2022)
https://doi.org/10.1063/5.0085965
ARTICLES
Theoretical Methods and Algorithms
Dynamic density functional theory for the charging of electric double layer capacitors
J. Chem. Phys. 156, 084101 (2022)
https://doi.org/10.1063/5.0081827
The influence of a Hamiltonian vibration vs a bath vibration on the 2D electronic spectra of a homodimer
J. Chem. Phys. 156, 084103 (2022)
https://doi.org/10.1063/5.0077404
Quantum chemistry-augmented neural networks for reactivity prediction: Performance, generalizability, and explainability
In Special Collection:
Chemical Design by Artificial Intelligence
J. Chem. Phys. 156, 084104 (2022)
https://doi.org/10.1063/5.0079574
Coupling mesoscale transport to catalytic surface reactions in a hybrid model
In Special Collection:
Fluids Meet Solids
J. Chem. Phys. 156, 084105 (2022)
https://doi.org/10.1063/5.0081829
Exact solution of polaritonic systems with arbitrary light and matter frequency-dependent losses
In Special Collection:
Advances in Modeling Plasmonic Systems
J. Chem. Phys. 156, 084106 (2022)
https://doi.org/10.1063/5.0077950
Reversible target-binding kinetics of multiple impatient particles
J. Chem. Phys. 156, 084107 (2022)
https://doi.org/10.1063/5.0083849
Hard-disk dipoles and non-reversible Markov chains
J. Chem. Phys. 156, 084108 (2022)
https://doi.org/10.1063/5.0080101
On the Breit interaction in an explicitly correlated variational Dirac–Coulomb framework
J. Chem. Phys. 156, 084110 (2022)
https://doi.org/10.1063/5.0075097
Variational Dirac–Coulomb explicitly correlated computations for atoms and molecules
J. Chem. Phys. 156, 084111 (2022)
https://doi.org/10.1063/5.0075096
Ground-state properties of the narrowest zigzag graphene nanoribbon from quantum Monte Carlo and comparison with density functional theory
In Special Collection:
Beyond GGA Total Energies for Solids and Surfaces
J. Chem. Phys. 156, 084112 (2022)
https://doi.org/10.1063/5.0078234
Entropy determination for mixtures in the adiabatic grand-isobaric ensemble
J. Chem. Phys. 156, 084113 (2022)
https://doi.org/10.1063/5.0083458
Correlated spectral fluctuations quantified by line shape analysis of fifth-order two-dimensional electronic spectra
In Special Collection:
Photosynthetic Light-Harvesting and Energy Conversion
J. Chem. Phys. 156, 084114 (2022)
https://doi.org/10.1063/5.0081053
Thermally activated intra-chain charge transport in high charge-carrier mobility copolymers
J. Chem. Phys. 156, 084115 (2022)
https://doi.org/10.1063/5.0082569
Tension between predicting accurate ground state correlation energies and excitation energies from adiabatic approximations in TDDFT
In Special Collection:
2022 JCP Emerging Investigators Special Collection
J. Chem. Phys. 156, 084116 (2022)
https://doi.org/10.1063/5.0080382
Dynamic surface patterns on cells
J. Chem. Phys. 156, 084117 (2022)
https://doi.org/10.1063/5.0077311
Advanced Experimental Techniques
Origin of layered perovskite device efficiencies revealed by multidimensional time-of-flight spectroscopy
J. Chem. Phys. 156, 084202 (2022)
https://doi.org/10.1063/5.0072976
Atoms, Molecules, and Clusters
Line mixing in the oxygen B band head
J. Chem. Phys. 156, 084301 (2022)
https://doi.org/10.1063/5.0079158
Excited states of lutetium oxide and its singly charged cation
J. Chem. Phys. 156, 084303 (2022)
https://doi.org/10.1063/5.0084483
Vibrational treatment of hydroxylamine in valence coordinates
J. Chem. Phys. 156, 084306 (2022)
https://doi.org/10.1063/5.0081289
Liquids, Glasses, and Crystals
Isotope effects on the structural transformation and relaxation of deeply supercooled water
In Special Collection:
Slow Dynamics
J. Chem. Phys. 156, 084501 (2022)
https://doi.org/10.1063/5.0078796
Phase transitions affected by natural and forceful molecular interconversion
J. Chem. Phys. 156, 084502 (2022)
https://doi.org/10.1063/5.0081180
Oxygen NMR of high-density and low-density amorphous ice
In Special Collection:
Slow Dynamics
J. Chem. Phys. 156, 084503 (2022)
https://doi.org/10.1063/5.0080333
Structures of glasses created by multiple kinetic arrests
In Special Collection:
Slow Dynamics
J. Chem. Phys. 156, 084504 (2022)
https://doi.org/10.1063/5.0080846
Confinement effects on glass-forming mixtures: Insights from a combined experimental approach to aqueous ethylene glycol solutions in silica pores
In Special Collection:
Slow Dynamics
J. Chem. Phys. 156, 084506 (2022)
https://doi.org/10.1063/5.0082406
Materials, Surfaces, and Interfaces
Electron–phonon effects on the photoacoustic response of gold core–silica shell nanoparticles: From the linear regime to nanocavitation
In Special Collection:
The Ever-Expanding Optics of Single-Molecules and Nanoparticles
J. Chem. Phys. 156, 084701 (2022)
https://doi.org/10.1063/5.0078457
Hydrogen-bonding and nuclear quantum effects in clays
In Special Collection:
JCP Editors' Choice 2022
,
2022 JCP Emerging Investigators Special Collection
J. Chem. Phys. 156, 084702 (2022)
https://doi.org/10.1063/5.0083075
Chemical Physics Software
DQC: A Python program package for differentiable quantum chemistry
J. Chem. Phys. 156, 084801 (2022)
https://doi.org/10.1063/5.0076202
Polymers and Soft Matter
Thixotropy and rheological hysteresis in blood flow
In Special Collection:
Memory Formation
J. Chem. Phys. 156, 084901 (2022)
https://doi.org/10.1063/5.0079214
Nonequilibrium free energy during polymer chain growth
J. Chem. Phys. 156, 084902 (2022)
https://doi.org/10.1063/5.0080786
A β-NMR study of the depth, temperature, and molecular-weight dependence of secondary dynamics in polystyrene: Entropy–enthalpy compensation and dynamic gradients near the free surface
In Special Collection:
Slow Dynamics
J. Chem. Phys. 156, 084903 (2022)
https://doi.org/10.1063/5.0081185
Microscopic structural origin behind slowing down of colloidal phase separation approaching gelation
In Special Collection:
Slow Dynamics
J. Chem. Phys. 156, 084904 (2022)
https://doi.org/10.1063/5.0080403
Transport coefficients of gel electrolytes: A molecular dynamics simulation study
J. Chem. Phys. 156, 084905 (2022)
https://doi.org/10.1063/5.0081118
Biological Molecules and Networks
Substrate rigidity modulates traction forces and stoichiometry of cell–matrix adhesions
In Special Collection:
The Ever-Expanding Optics of Single-Molecules and Nanoparticles
J. Chem. Phys. 156, 085101 (2022)
https://doi.org/10.1063/5.0077004
Advanced Experimental Techniques
Membrane potential sensing: Material design and method development for single particle optical electrophysiology
In Special Collection:
The Ever-Expanding Optics of Single-Molecules and Nanoparticles
J. Chem. Phys. 156, 084201 (2022)
https://doi.org/10.1063/5.0076522
