Year of publication
Type of media
Source
Type of material
Licence
Language
1–20 of 34,990 hits
Sort by:
Sort by:
-
A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactionsElectronic supplementary information (ESI) available: Details on the new MB16-43 set. Damping parameters for the DFT-D3 dispersion correction. Comparison between the new and old reference values for ALX6. Dispersion-corrected vs. -uncorrected results. Analysis of best and worst MAD/RMSD. Weighted total mean absolute deviations. Statistical results for all test sets and DFAs. See DOI: 10.1039/c7cp04913g
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
Accurately extracting the signature of intermolecular interactions present in the NCI plot of the reduced density gradient versus electron densityElectronic supplementary information (ESI) available. See DOI: 10.1039/c7cp02110k
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
NMR reveals the surface functionalisation of Ti3C2 MXeneElectronic supplementary information (ESI) available: Experimental details, additional NMR spectra and EDS analysis of the Ti3C2Tx samples. See DOI: 10.1039/c6cp00330c
Online Contents | 2016|Publisher: The Royal Soc. of Chemistry, Cambridge -
Metal-oxide-semiconductor based gas sensors: screening, preparation, and integration
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
Comprehensive evaluation of ten docking programs on a diverse set of protein-ligand complexes: the prediction accuracy of sampling power and scoring powerElectronic supplementary information (ESI) available: Fig. S1: distributions of five properties of 1790 FDA approved drugs; Table S1: the unsuccessful docking instances of the individual tested docking program in the benchmark; and Table S2: the formal charge and the number of rotatable bonds of ligands for the 72 failure cases that could not be successfully predicted by any docking program. See DOI: 10.1039/c6cp01555g
Online Contents | 2016|Publisher: The Royal Soc. of Chemistry, Cambridge -
Carbon nitrides: synthesis and characterization of a new class of functional materials
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
Comparing molecules and solids across structural and alchemical spaceElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp00415f
Online Contents | 2016|Publisher: The Royal Soc. of Chemistry, Cambridge -
On the lag phase in amyloid fibril formation
Online Contents | 2015|Publisher: The Royal Soc. of Chemistry, Cambridge -
Electrochemical in situ investigations of SEI and dendrite formation on the lithium metal anode
Online Contents | 2015|Publisher: The Royal Soc. of Chemistry, Cambridge -
The effect of electrolyte composition on the electroreduction of CO2 to CO on Ag based gas diffusion electrodesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp05665a
Online Contents | 2016|Publisher: The Royal Soc. of Chemistry, Cambridge -
A practical guide to using boron doped diamond in electrochemical research
Online Contents | 2015|Publisher: The Royal Soc. of Chemistry, Cambridge -
Exfoliating biocompatible ferromagnetic Cr-trihalide monolayers
Online Contents | 2016|Publisher: The Royal Soc. of Chemistry, Cambridge -
Recent research progress in non-aqueous potassium-ion batteries
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
Metal-organic frameworks for photocatalysis
Online Contents | 2016|Publisher: The Royal Soc. of Chemistry, Cambridge -
Tetrel, pnictogen and chalcogen bonds identified in the gas phase before they had names: a systematic look at non-covalent interactions
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
Electronic properties of blue phosphorene/graphene and blue phosphorene/graphene-like gallium nitride heterostructuresElectronic supplementary information (ESI) available. See DOI: 10.1039/c7cp01852e
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
A review of methods for the calculation of solution free energies and the modelling of systems in solution
Online Contents | 2015|Publisher: The Royal Soc. of Chemistry, Cambridge -
Electronic properties of reduced molybdenum oxides
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge -
Cesium power: low Cs+ levels impart stability to perovskite solar cellsElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp08022g
Online Contents | 2017|Publisher: The Royal Soc. of Chemistry, Cambridge
Send my search to (beta)
Send your search query (search terms without filters) to other databases, portals and catalogues to find more interesting hits.
Dimensions:
full data search
or
title and abstract search
Dimensions is a database for abstracts and citations that links information on research funding with the resulting publications, studies and patents.
TIB AV portal
In the TIB AV-Portal, audiovisual media from science and teaching can be foundand own scientific videos can be published.
Specialised Information Service for Mobility and Transport Research (FID move)
Open Research Knowledge Graph (ORKG)
The FID move can be used to search for subject-specific literature, research data and other information from mobility and transport research.
The Open Research Knowledge Graph provides structured descriptions of research content and makes it comparable.
Common Union Catalogue (GVK)
Freely accessible part of the collaborative K10plus catalogue with materials relevant for interlibrary loan and direct delivery services.