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Complexation‐Mediated Diffusion‐Limited Crystal Growth: A General Framework for Anisotropic Crystal Growth in Cu‐Based Perovskites

Advanced Functional Materials, EarlyView.
A Complexation‐Mediated Diffusion‐Limited Growth (CMDLG) framework is established to rationalize the anisotropic growth of lead‐free perovskites. Integrating coordination chemistry with mass transport kinetics, this study theoretically derives and experimentally validates that stable iodocuprate complexes induce a diffusion‐limited regime.
Hyunmin Lee, Mu Geun Son, Thanh Van Vu, Hokyeong Jeong, Joonhee Kang, Youngjong Kang   +5 more
wiley   +1 more source

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Electrostatic interaction of soft particles

Advances in Colloid and Interface Science, 2015
Theories of the electrostatic interaction between two soft particles (i.e., particles covered with an ion-penetrable surface layer of polyelectrolytes) in an electrolyte solution are reviewed. Interactions of soft particles after contact of their surface layers are particularly discussed. Interaction in a salt-free medium and the discrete-charge effect
Hiroyuki Ohshima
exaly   +3 more sources

Electrostatic interaction between soft particles

Journal of Colloid and Interface Science, 2008
Electrostatic interaction between two soft particles (i.e., polyelectrolyte-coated particles) in an electrolyte solution is discussed. An approximate analytic expression for the interaction energy between two dissimilar soft spheres is derived by applying Derjaguin's approximation to the corresponding interaction energy between two parallel dissimilar ...
Hiroyuki Ohshima
exaly   +3 more sources

Evaluation of Electrostatic Interactions

Current Protocols in Bioinformatics, 2003
AbstractDescribed here are several computational procedures for the analysis of electrostatic interactions in molecular complexes, all based on a continuum model of solvation. The first section describes how to compute the residual potential, a measure of how electrostatically complementary a ligand is for its receptor.
David F, Green, Bruce, Tidor
openaire   +2 more sources

Electrostatic interactions in polyglutamic acid

Biopolymers, 1973
AbstractConformational energy estimates were made for completely charged polyglutamic acid with different assumptions concerning the placement of side chain charge. Viewed as a helix, the minimum energy structure is somewhat affected by the side‐chain charge placement. The average energy of the chain viewed as a random coil is equal to or less than the
J H, Rai, W G, Miller
openaire   +2 more sources

Electrostatic interaction in dusty plasma

Physical Review E, 2002
Two modifications of the standard description of electrostatic interaction in a dusty plasma are emphasized. First, the Coulomb-type potential profile is not applicable at very short distances around a dust grain, due to the polarization of the charge on the grain, i.e., the image charge effect, and, second, at larger distances, the standard Debye ...
J, Vranjes, M Y, Tanaka, B P, Pandey, M, Kono   +3 more
openaire   +2 more sources

Electrostatic interactions at charged lipid membranes. Electrostatically induced tilt

Biochemistry, 1979
The changes in bilayer structure induced by surface charges in the case of an ionizable lipid were studied by X-ray diffraction, Raman spectroscopy, and film-balance measurements. With increasing surface charge in the ordered phase, the X-ray results show a decrease in bilayer thickness, whereas the hydrocarbon chain packing stays essentially constant,
F, Jähnig, K, Harlos, H, Vogel, H, Eibl
openaire   +2 more sources

Electrostatics Interactions in Classical Simulations

2012
Electrostatic interactions are crucial for both the accuracy and performance of atomistic biomolecular simulations. In this chapter we review well-established methods and current developments aiming at efficiency and accuracy. Specifically, we review the classical Ewald summations, particle-particle particle-method particle-method Ewald algorithms ...
G Andrés, Cisneros, Volodymyr, Babin, Celeste, Sagui   +2 more
openaire   +2 more sources

Electrostatic effects in homeodomain-DNA interactions

Journal of Molecular Biology, 1997
We report here an investigation of the role of electrostatics in homeodomain-DNA interactions using techniques based around the use of the Poisson-Boltzmann equation. In the present case such a study is of particular interest, since in contrast to other proteins previously studied with this method, the homeodomain is a small, highly charged protein ...
FOGOLARI, Federico, Elcock AH, ESPOSITO, Gennaro, VIGLINO, Paolo, Briggs JM, McCammon JA   +5 more
openaire   +3 more sources

Electrostatic Interactions across a β-Sheet

Biochemistry, 1997
The free energy consequences of electrostatic interactions across a model beta-sheet have been probed using a consensus zinc finger peptide. Relative folding free energies have been deduced from coupled peptide folding/metal binding reactions. The energies of the electrostatic interactions have been isolated via double mutant cycles performed at a ...
C A, Blasie, J M, Berg
openaire   +2 more sources