Concept

Homo rudolfensis

Publications associées (5)

Electrochemical potential window of battery electrolytes: the HOMO-LUMO misconception

A widespread misconception in the lithium ion battery literature is the equality of the energy difference of HOMO and LUMO of the solvent with the electrochemical stability window. HOMO and LUMO are concepts derived from approximated electronic structure t ...

2018

Molecular Engineering of Iridium Blue Emitters Using Aryl N-Heterocyclic Carbene Ligands

Mohammad Khaja Nazeeruddin, Iwan Zimmermann, Giulia Grancini, Aron Joel Huckaba, Sadig Aghazada

The synthesis of a new series of neutral bis[2-(2,4-difluorophen-2-yl)pyridine][1-(2-aryl)-3-methylimidazol-2-ylidene]iridium(III) complexes is reported. Each complex has been characterized by NMR spectroscopy, UV/Vis spectrophotometry, and cyclic voltamme ...

Wiley-Blackwell2016

New pyrido[3,4-b]pyrazine-based sensitizers for efficient and stable dye-sensitized solar cells

Shaik Mohammed Zakeeruddin, Jacques-Edouard Moser, Pascal Comte, Thomas Moehl, Mateusz Barnaba Wielopolski, Jiabao Yang

A series of new pyrido[3,4-b]pyrazine-based organic sensitizers (PP-I and APP-I–IV) containing different donors and p-spacers have been synthesized and employed in dye-sensitized solar cells (DSSCs). The absorption spectra properties of dyes are analysed b ...

Royal Soc Chemistry2014

Insight from First-Principles Calculations into the Interactions between Hydroxybenzoic Acids and Alkali Chloride Surfaces

Wei Chen

Tuning of effective band gaps at insulator surfaces by adsorbed molecules is of fundamental interest but also technologically relevant for contact charging induced by adsorbed molecules like hydroxybenzoic acids. Our studies by density functional theory of ...

American Chemical Society2010

Offset Profiles of Selective Pulses in Isotopically Labeled Macromolecules

Geoffrey Bodenhausen

The exptl. verification of offset profiles and calibration of selective pulses in NMR is usually carried out with doped water samples but not under conditions typical of macromols. with short T2, long T1, and possibly homo- and heteronuclear couplings. A n ...

1999

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