Results 191 to 200 of about 11,111,834 (347)

Excited-State Chemistry of Hydroperoxymethyl Thioformate in the Troposphere. [PDF]

J Phys Chem A
Catalán-Fenollosa D, Telles do Casal M, Carmona-García J, Saiz-Lopez A, Escudero D, Roca-Sanjuán D.   +5 more
europepmc   +1 more source

Exploration of Pseudobinary Alloys (Al–Mn)‐(Co–Fe–Ni) to Design High‐Entropy and Compositionally Complex Alloys to Stabilize the τ Phase in Al–Mn‐Based Ferromagnetic Alloys

Advanced Engineering Materials, EarlyView.
This experimental study investigates the thermodynamic limits of the Al–Mn τ ferromagnetic phase within complex‐composition alloys (CCAs). Using nine rare‐earth‐free compositions, it explores a broad region of the pseudobinary AlMnCoFeNi system. The results reveal intricate links between composition, phase stability, and magnetic behavior, highlighting
Sacha Plagnol‐Chauzu, Laurent Peltier, Fodil Meraghni, Stéphane Delalande, Frédéric Mazaleyrat   +4 more
wiley   +1 more source

Quantum-Indeterminate Proton Positions in Ultrafast Excited-State Intramolecular Proton Transfer. [PDF]

J Phys Chem Lett
Lee M, Lee C, Kim J.
europepmc   +1 more source

Exploring Dipolar Dynamics and Ionic Transport in Metal‐Organic Frameworks: Experimental and Theoretical Insights

Advanced Functional Materials, EarlyView.
In this study, the interplay of dipolar dynamics and ionic charge transport in MOF compounds is investigated. Synthesizing the novel structure CFA‐25 with integrated freely rotating dipolar groups, local and macroscopic effects, including interactions with Cs cations are explored.
Ralph Freund, Arthur Schulz, Peter Lunkenheimer, Maryana Kraft, Thomas Bergler, Harald Oberhofer, Dirk Volkmer   +6 more
wiley   +1 more source

Excited-State Energy Decomposition Analysis. [PDF]

Annu Rep Comput Chem
Gao J, Liu C, Chen K.
europepmc   +1 more source

Photoswitchable Conductive Metal–Organic Frameworks

Advanced Functional Materials, EarlyView.
A conductive material where the conductivity can be modulated remotely by irradiation with light is presented. It is based on films of conductive metal–organic framework type Cu3(HHTP)2 with embedded photochromic molecules such as azobenzene, diarylethene, spiropyran, and hexaarylbiimidazole in the pores.
Yidong Liu, Mersad Mostaghimi, Abhinav Chandresh, Saibal Jana, Wolfgang Wenzel, Lars Heinke   +5 more
wiley   +1 more source

Intermolecular Interactions as Driving Force of Increasing Multiphoton Absorption in a Perylene Diimide‐Based Coordination Polymer

Advanced Functional Materials, EarlyView.
This study uncovers the unexplored role of intermolecular interactions in multiphoton absorption in coordination polymers. By analyzing [Zn2tpda(DMA)2(DMF)0.3], it shows how the electronic coupling of the chromophores and confinement in the MOF enhance two‐and three‐photon absorption.
Simon Nicolas Deger, Anna Mauri, Yang Cui, Sebastian Josef Weishäupl, Ali Deniz Özdemir, Hamad Syed, Aleksandr Ovsianikov, Wolfgang Wenzel, Alexander Pöthig, Jürgen Hauer, Mariana Kozlowska, Roland Augustinus Fischer   +11 more
wiley   +1 more source

Exploring Excited State Proton Transfer Dynamics upon Ultraviolet Excitation. [PDF]

J Phys Chem A
Kaul N, Benny A, Petropoulos V, Maj M, Cerullo G, Maiuri M, Scholes GD.   +6 more
europepmc   +1 more source

NanoMOF‐Based Multilevel Anti‐Counterfeiting by a Combination of Visible and Invisible Photoluminescence and Conductivity

Advanced Functional Materials, EarlyView.
This study presents novel anti‐counterfeiting tags with multilevel security features that utilize additional disguise features. They combine luminescent nanosized Ln‐MOFs with conductive polymers to multifunctional mixed‐matrix membranes and powder composites. The materials exhibit visible/NIR emission and matrix‐based conductivity even as black bodies.
Moritz Maxeiner, Ruben Maile, Murat Cuvalli, Andreas Wolf, Ayisha Komal, Robert Oestreich, Christoph Janiak, Karl Mandel, Alexander Knebel, Klaus Müller‐Buschbaum   +9 more
wiley   +1 more source

A detailed comparison of ΔSCF methods with the constraint-based orbital-optimized excited state method. [PDF]

Commun Chem
Lemke Y, Kussmann J, Ochsenfeld C.
europepmc   +1 more source