Results 201 to 210 of about 115,920 (303)

Not just a branch but the blossom of the tree of knowledge: The rise – and blossoming – of physical and theoretical chemistry

, 2017
Břetislav Friedrich
openalex   +1 more source

Band Alignment in In‐Oxo Metal Porphyrin SURMOF Heterojunctions

Advanced Functional Materials, EarlyView.
Porphyrin core metalation in indium‑oxo SURMOFs enables systematic tuning of band edge positions without altering the crystal structure. First‑principles calculations reveal type‑I and type‑II heterostructures as well as multi‑junction energy cascades, establishing a modular strategy for exciton funneling and charge separation in optoelectronic ...
Puja Singhvi, Nina Vankova, Thomas Heine
wiley   +1 more source

Computational investigation of thermodynamic properties of gas phase vanadium nitride using Python. [PDF]

Sci Rep
Yame MP, Akeremale OC, Iyen C, Emem-Obong SJ, Targema TV, Falaye BJ.   +5 more
europepmc   +1 more source

On‐Surface Indigo‐Based Bimolecular Coordination Networks with Programmable Regular or Vitreous Structure

Advanced Functional Materials, EarlyView.
A previously unreported coordination motif stabilising single Fe atoms by indigo chelation and pyridyl coordination on Au(111) has been revealed. By using planar tritopic pyridyl linkers (TPyB), extended 2D porous networks of indigo3(TPyB)2Fe6 form. These networks can be crystalline or vitreous and offer an environment where individual coordination ...
Hongxiang Xu, Ritam Chakraborty, Biao Yang, Dennis Meier, Joachim Reichert, Svetlana Klyatskaya, Mario Ruben, Shobhana Narasimhan, Johannes V. Barth, Anthoula C. Papageorgiou   +9 more
wiley   +1 more source

Synthesis, characterization, DFT calculation, and biological activity of a new Schiff base ligand and its ZnO and Co₃O₄ nano-metal oxide complexes. [PDF]

BMC Chem
Hasan AW, Zubaidi ZN, Mustafa MY, Abdul Karem LK, Ahmed RM, Al-Samrai OAY, Al-Darwesh MY, Qader IN, Babakr KA.   +8 more
europepmc   +1 more source

Academic Position "Professor in Theoretical Chemistry" at the Department of Physical Chemistry, University of Sofia: Doc. Dr. Alya Tadjer

, 2011
B.V. Toshev
openalex   +1 more source

Photoswitching Conduction in Framework Materials

Advanced Functional Materials, EarlyView.
This mini‐review summarizes recent advances in state‐of‐the‐art proton and electron conduction in framework materials that can be remotely and reversibly switched on and off by light. It discusses the various photoswitching conduction mechanisms and the strategies employed to enhance photoswitched conductivity.
Helmy Pacheco Hernandez, Stefan Hecht, Wolfgang Wenzel, Lars Heinke, Mariana Kozlowska   +4 more
wiley   +1 more source

Structure-Response Relationships in Rigid C₂-Symmetric Excitonic Systems: Principles, Modulation, and Functional Design Strategies. [PDF]

Chemphyschem
Gómez-Oya I, Portela-Pino J, Ozcelik A, Alonso-Gómez JL.   +3 more
europepmc   +1 more source

Anisotropic Shear Properties of Organic Interfaces in Bio‐composite Materials

Advanced Functional Materials, EarlyView.
A novel cantilever design enables direct probing of shear properties at single organic interfaces within biocomposite prismatic ultrastructures. By decoupling lateral and torsional shear responses, the method reveals isotropic behavior in Atrina vexillum and pronounced anisotropy in Unio pictorum.
Kian Tadayon, Benny Bar‐On, Igor Zlotnikov   +2 more
wiley   +1 more source

Tunable Coordination Number in Non‐Metal‐Introduced Copper Catalysts Enables High‐Performance Electrochemical CO2 Reduction to C2 Products

Advanced Functional Materials, EarlyView.
Copper catalysts introduced with different non‐metallic elements regulating the coordination number of Cu are prepared by magnetron sputtering. Reducing the Cu coordination number enhances C─C coupling and boosts C2+ product selectivity, by lowering the energy barrier for the *CO → *CHO conversion step. The optimized Si‐doped Cu catalyst achieves a C2+
Xiaoye Du, Bo Gao, Yixuan Yang, Young In Jo, Dan Qian, Chunhui Xiao, Shujiang Ding, Zhongxiao Song, Ki Tae Nam   +8 more
wiley   +1 more source