Results 31 to 40 of about 7,446,249 (178)
, 2015 The second virial coefficient, B 2 is computed of linear rigid rods composed of m equally spaced sites interacting with sites on other rods via the hard-sphere or Weeks-Chandler-Andersen (WCA) pair potentials.
English, R. J. +4 more
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Polymer Brushes Govern Defect‐Selective Oxidative Etching of Penta‐Twinned Gold Nanorods
Angewandte Chemie, Volume 138, Issue 39, 21 September 2026.Polymer brushes act as active interfacial regulators of oxidative etching, directing it to crystallographic defects. In penta‐twinned gold nanorods, defect–ligand interplay localizes etching to defect regions and induces surface corrugations on the long nanorod sides. This work establishes a framework for programmable nanoengineering of the surfaces of
Tianyi Wu +9 more
wiley +2 more sources
Chemical Thermodynamics and Thermal Analysis, 2022 Excess internal pressure of solution and excess partial molar volume of solute data embedded in the parameter reversible isothermal work (W) have been used to calculate the ion–ion pair correlation functions (gij(r), r being distance) and the ...
Preeti A. Tomar +2 more
doaj +1 more source
Advanced Science, EarlyView.An “Interface Reactor” strategy boosts simulation stability by 2–3 orders of magnitude, enabling stable 100 ns molecular dynamics of electrode‐electrolyte interfaces. Distinct SEI formation mechanisms are revealed: mixed co‐formation in carbonates versus surface‐energy‐controlled NaF crystallization in ethers. Metadynamics simulations further elucidate
Zhoulin Liu +6 more
wiley +1 more source
Study of CH4 and CO2 competitive adsorption on shale in Yibin, Sichuan Province of China
Carbon Resources Conversion, 2019 Shale gas is an unconventional gas source with substantial development potential. In this study, Longmaxi Formation shale from the Silurian system in Yibin, Sichuan Province was collected for characterizing total organic carbon (TOC), clay mineral ...
Yue Ma +4 more
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Unveiling the Ultralow Thermal Conductivity of Hybrid Perovskites
Advanced Science, EarlyView.In hybrid perovskites, thermal energy flows through lattice vibrations of the framework (48%–65%) and organic molecules (35%–52%). When the disorder introduced by organic molecules is excluded, the temperature dependence of the vibrational thermal conductivity results from the lattice framework transits from ∼T0 to ∼T−1, and the value doubles at room ...
Qinqin He +3 more
wiley +1 more source
The role of the second virial coefficient in the vapor-liquid phase coexistence of anisotropic square-well particles [PDF]
, 2022 We examine the role of the second virial coefficient in the vapor-liquid (VL) phase coexistence of anisotropic hard bodies with square-well attractions of variable range.
Varga, Szabolcs +2 more
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A Study on the Second Virial Coefficient of Water Vapor [PDF]
, 1976 It is well-known that the equation of state for real gas is expressed by the virial form. The determination of the second virial coefficient is not only the first step to formulate the virial equation but also important in order to study the interaction ...
中嶋, 宏, 近藤, 博美
core
The second dielectric virial coefficient of the dipolar Gay–Berne fluid
, 1999 We report the second dielectric virial coefficient Bε of a nonpolarizable dipolar Gay-Berne fluid. The second dielectric virial coefficient is evaluated for several sets of shape parameters and temperature.
Y Tantirungrotechai, A D Buckingham
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Communications Biology, 2023 Liquid-liquid phase separation of protein solutions has regained heightened attention for its biological importance and pathogenic relevance. Coarse-grained models are limited when explaining residue-level effects on phase equilibrium.
Sanbo Qin, Huan-Xiang Zhou
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