Joint structure refinement of x-ray and neutron diffraction data on disordered materials: application to liquid water.
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Reintroducing Electrostatics into Macromolecular Crystallographic Refinement: Application to Neutron Crystallography and DNA HydrationStructure of the floating water bridge and water in an electric fieldDiffraction and IR/Raman data do not prove tetrahedral water.Comparison of interaction potentials of liquid water with respect to their consistency with neutron diffraction data of pure heavy water.Oxygen-oxygen correlations in liquid water: addressing the discrepancy between diffraction and extended x-ray absorption fine-structure using a novel multiple-data set fitting technique.Identifying and characterising the different structural length scales in liquids and glasses: an experimental approach.Incorporating Phase-Dependent Polarizability in Non-Additive Electrostatic Models for Molecular Dynamics Simulations of the Aqueous Liquid-Vapor Interface.Microscopic structure of water at elevated pressures and temperaturesSystematic improvement of a classical molecular model of waterNearest-neighbor oxygen distances in liquid water and ice observed by x-ray Raman based extended x-ray absorption fine structure.Water-peptide site-specific interactions: a structural study on the hydration of glutathione.Simulating water with rigid non-polarizable models: a general perspective.Growing correlation length in supercooled water.The Effect of Water upon Deep Eutectic Solvent Nanostructure: An Unusual Transition from Ionic Mixture to Aqueous Solution.Direct comparisons of experimental and calculated neutron structure factors of pure solvents as a method for force field validation.Properties of water along the liquid-vapor coexistence curve via molecular dynamics simulations using the polarizable TIP4P-QDP-LJ water model.Size, separation, structural order, and mass density of molecules packing in water and ice.Wide-angle X-ray diffraction and molecular dynamics study of medium-range order in ambient and hot water.The structure of glycerol in the liquid state: a neutron diffraction study.Benchmark oxygen-oxygen pair-distribution function of ambient water from x-ray diffraction measurements with a wide Q-range.Triplet correlation functions in liquid water.Coarse-grained ions without charges: reproducing the solvation structure of NaCl in water using short-ranged potentials.Enhanced small-angle scattering connected to the Widom line in simulations of supercooled water.How well can polarization models of pairwise nonadditive forces describe liquid water?Analyzing the errors of DFT approximations for compressed water systems.Highly compressed water structure observed in a perchlorate aqueous solution.Disentangling structural information from core-level excitation spectra.Nuclear quantum effects in water.Semiquantal molecular dynamics simulations of hydrogen-bond dynamics in liquid water using multi-dimensional Gaussian wave packets.Coupled cluster benchmarks of water monomers and dimers extracted from density-functional theory liquid water: the importance of monomer deformations.Can a Century Old Experiment Reveal Hidden Properties of Water?The behaviour of tributyl phosphate in an organic diluentInsights into the ultraviolet spectrum of liquid water from model calculations: The different roles of donor and acceptor hydrogen bonds in water pentamersA Review of High-Energy X-Ray Diffraction from Glasses and LiquidsThe Radial Distribution Functions of Water as Derived from Radiation Total Scattering Experiments: Is There Anything We Can Say for Sure?
P2860
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P2860
Joint structure refinement of x-ray and neutron diffraction data on disordered materials: application to liquid water.
description
2007 nî lūn-bûn
@nan
2007 թուականի Յուլիսին հրատարակուած գիտական յօդուած
@hyw
2007 թվականի հուլիսին հրատարակված գիտական հոդված
@hy
2007年の論文
@ja
2007年論文
@yue
2007年論文
@zh-hant
2007年論文
@zh-hk
2007年論文
@zh-mo
2007年論文
@zh-tw
2007年论文
@wuu
name
Joint structure refinement of ...... : application to liquid water.
@ast
Joint structure refinement of ...... : application to liquid water.
@en
type
label
Joint structure refinement of ...... : application to liquid water.
@ast
Joint structure refinement of ...... : application to liquid water.
@en
prefLabel
Joint structure refinement of ...... : application to liquid water.
@ast
Joint structure refinement of ...... : application to liquid water.
@en
P356
P1476
Joint structure refinement of ...... : application to liquid water.
@en
P2093
P304
P356
10.1088/0953-8984/19/33/335206
P577
2007-07-04T00:00:00Z