Advanced Search
Displaying assets from 1 to 30 out of 1948
-
Description Natural charges and dipole moments in the various complexes.
Article Title: Counterion‐Trapped‐Molecules: From High Polarity and Enriched IR Spectra to Induced Isomerization
Publication Title: ChemPhysChem -
Description Microscopic characterization of eGNRs. STM (top) and nc‐AFM (bottom) images of eGNR on Au(111). STM image scan parameters: 0.1 V, 10 pA.
Article Title: On‐Surface Synthesis and Spectroscopic Characterization of Laterally Extended Chevron Graphene Nanoribbons
Publication Title: ChemPhysChem -
Description SEM images of Th0.85Y0.15O1.925 and Th0.78Y0.22O1.89 sintered samples.
Article Title: Synthesis and Direct Sintering of Nanosized (MIV,MIII)O2‐x Hydrated Oxides as Electrolyte Ceramics
Publication Title: ChemPhysChem -
Description Labels of the carbon atoms of phenanthroline, representation of the LUMO (b1) and the LUMO+1 (a2).
Article Title: Assessment of Density Functionals for Computing Thermodynamic Properties of Lanthanide Complexes
Publication Title: ChemPhysChem -
Description Top view SEM images of MAPbI3 perovskite films based on (a) NiOx and (b) Li:NiOx on ITO glass substrates. The scale bar is 1 μm. (c) UV‐Vis spectra of the perovskite films, (d) steady‐state...
Article Title: The Effect of Lithium Doping in Solution‐Processed Nickel Oxide Films for Perovskite Solar Cells
Publication Title: ChemPhysChem -
Description pH* dependence of the observed second‐order rate constants of the reduction of His by Tyr: (a) for the systems of acetylated and non‐acetylated amino acids; (b) for the His‐Phe pepide/N‐AcTyr...
Article Title: Reduction of Transient Histidine Radicals by Tyrosine: Influence of the Protonation State of Reactants
Publication Title: ChemPhysChem -
Description Conductance histogram for Fe (a), Ni (b), Pd (c), Cu (d), Ag (e), and Au (f) junction before (black line) and after (red line) introduction of DCE.
Article Title: Structure and Electron Transport at Metal Atomic Junctions Doped with Dichloroethylene
Publication Title: ChemPhysChem -
Description Left: representation of a 2×2 supercell of the ZIF‐8 structure, highlighting the SOD topology of the framework with brown lines drawn between neighboring Zn2+ ions (in green). Top right: views of...
Article Title: Molecular Mechanism of Swing Effect in Zeolitic Imidazolate Framework ZIF‐8: Continuous Deformation upon Adsorption
Publication Title: ChemPhysChem -
Description Summary of small molecule inhibitors that target the EED subunit of PRC2 complex.
Article Title: Binding Modes of Small‐Molecule Inhibitors to the EED Pocket of PRC2
Publication Title: ChemPhysChem -
Description A) 8‐Hz selHSQMBC and B) 3‐Hz LR‐selHSQMBC spectra of 1,2,4‐triazolo[1,5‐a]pyrimidine (1) after selective refocusing of the H‐2 proton with a 10 ms Gaussian‐shaped 180° 1H pulse. C) Expansion...
Article Title: LR‐selHSQMBC: Simultaneous Detection and Quantification of Very Weak Long‐Range Heteronuclear NMR Correlations
Publication Title: ChemPhysChem -
Description Simulations and fitting of H*, OH* and Cl* coverages (a–c), the derived CV (d–f ) and the experimental CV (g–i) in acidic (HClO4+KCl) for the three Cu facets. The Cl anion, known to poison...
Article Title: Ab Initio Cyclic Voltammetry on Cu(111), Cu(100) and Cu(110) in Acidic, Neutral and Alkaline Solutions
Publication Title: ChemPhysChem -
Description a) SEM image of CC@MnO2. b) TEM image of CC@MnO2. c) Voltage versus charge‐discharge capacity profiles of the cathode CC@0.5MnO2@Na2S6 (MnO2 loading 0.5 mg cm−2) at 0.2 A g−1. d) S 2p3/2 spectrum...
Article Title: Recent Advances in Cathode Materials for Room‐Temperature Sodium−Sulfur Batteries
Publication Title: ChemPhysChem -
Description G4(MP2) calculated anion affinitiesa [kJ mol−1] of BeX and MgX tri‐substituted cyclopropane derivatives (X=Me, F, Cl, CN).
Article Title: Be‐ and Mg‐Based Electron and Anion Sponges
Publication Title: ChemPhysChem -
Description a) Results of the AdNDP analysis and b) Isolines of Bindz for the CaGa2C6H3+ cluster.
Article Title: Embedding a Planar Hypercoordinate Carbon Atom into a [4n+2] π‐System
Publication Title: ChemPhysChem -
Description Deconvolution results of S 2p3/2 for the S:DIB+LiTFSI sample.
Article Title: Electronic Structure Characterization of Cross‐Linked Sulfur Polymers
Publication Title: ChemPhysChem -
Description 1H water proton relaxivity of Gd‐HPDO3A at 40 MHz as a function of the concentration of crosslinked HA.
Article Title: Relaxivity of Gd‐Based MRI Contrast Agents in Crosslinked Hyaluronic Acid as a Model for Tissues
Publication Title: ChemPhysChem -
Description The reductive citric acid cycle (RCC) as taken from Ref. [6c].
Article Title: On the Role of Water as a Catalyst in Prebiotic Chemistry
Publication Title: ChemPhysChem -
Description Br 3d core level spectra of the Br2Py precursors adsorbed on Au(111) from self‐assemble to 473 K, 523 K and 573 K annealing, respectively. Raw data is plotted with dots, while fitted components are...
Article Title: Structural Transformation of 2,7‐Dibromopyrene on Au(111) Mediated by Halogen‐Bonding Motifs
Publication Title: ChemPhysChem -
Description Models of the Sierpiński triangles.
Article Title: Construction and Properties of Sierpiński Triangular Fractals on Surfaces
Publication Title: ChemPhysChem -
Description Representation of the Au–18‐syn–Au junction. (Adapted with permission from Ref. . Copyright 2013 American Chemical Society.)
Article Title: Phosphorus‐Containing Polycyclic Aromatic Hydrocarbons
Publication Title: ChemPhysChem -
Description Constant current STM images of polymeric phase. (a) 50 nm2 (U=1.4 V, I=140 pA). (b) 25 nm2 (U=1.4 V, I=140 pA). (c) 12.5 nm2 (U=1.5 V, I=1.0 nA) with superimposed wireframe model where only the...
Article Title: Hierarchy in the Halogen Activation During Surface‐Promoted Ullmann Coupling
Publication Title: ChemPhysChem -
Description Luminescence data for the europium cryptates 2‐Nd and 3‐Nd in CD3OD.
Article Title: Radiative Lifetime, Non‐Radiative Relaxation, and Sensitization Efficiency in Luminescent Europium and Neodymium Cryptates – The Roles of 2,2′‐Bipyridine‐N,N′‐dioxide and Deuteration
Publication Title: ChemPhysChem -
Description A) Pressure–area isotherms of F8H16 in air (dashed) and PFH‐enriched atmosphere (solid) measured at 20 °C with a compression speed of 3.75 cm2/min. The inset is a schematic illustration of FnHm...
Article Title: Influence of Perfluorohexane‐Enriched Atmosphere on Viscoelasticity and Structural Order of Self‐Assembled Semifluorinated Alkanes at the Air‐Water Interface
Publication Title: ChemPhysChem -
Description Experimental and calculated g‐values for MSK radical anions in different environments. All experimental values are determined from simulations of Q‐band EPR spectra. Numbers in parentheses are the...
Article Title: Probing the Menasemiquinone Binding Mode to Nitrate Reductase A by Selective 2H and 15N Labeling, HYSCORE Spectroscopy, and DFT Modeling
Publication Title: ChemPhysChem -
Description Response of the sensors to 100 ppm CO (210 °C, 50 % RH) before and after storage for 1 month at room temperature.
Article Title: Organometallic Synthesis of CuO Nanoparticles: Application in Low‐Temperature CO Detection
Publication Title: ChemPhysChem -
Description The gas bubble is the nonextensive phase in contact with the medium through an ill‐defined interface (fuzzy interface).
Article Title: Bubble Solution Description by Non‐Extensive Thermodynamics: Pressure Effect
Publication Title: ChemPhysChem -
Description On the left: Molecular electron densities projected on the long axis of a typical molecule and the ellipsoidal (and spherical) electron densities as incorporated in the GB‐particles. The lengths...
Article Title: Molecular Electron Density Distribution and X‐Ray Diffraction Patterns of Smectic A Liquid Crystals – A Simulation Study
Publication Title: ChemPhysChem -
Description a) Left side: Electron‐transfer‐driven reactions: redox reaction in solution (i) and electrochemical reaction at electrode‐electrolyte interface (ii); the spot illustrates the overall process not...
Article Title: Advances in Electrocatalysis for Energy Conversion and Synthesis of Organic Molecules
Publication Title: ChemPhysChem -
Description Set of receptors used for the study.
Article Title: A Preorganized Hydrogen‐Bonding Motif for the Molecular Recognition of Carbohydrates
Publication Title: ChemPhysChem -
Description Two processes of photochemical reaction on a molecule adsorbed on a surface: a) Direct intramolecular excitation of one electron of the HOMO of the molecule towards its LUMO due to light‐absorption...
Article Title: Photochemistry Highlights on On‐Surface Synthesis
Publication Title: ChemPhysChem