Results 201 to 210 of about 71,384 (267)

Atomic-Scale Mapping of Interfacial Water on Oxide Surfaces via Proton-Resolved NMR and <i>Ab Initio</i> Simulations. [PDF]

J Am Chem Soc
Agosta L, Conover K, Rzepka P, Gordeeva A, Slabon A, Pelczer I, Selloni A, Hermansson K, Jaworski A.   +8 more
europepmc   +1 more source

Selective Optical Properties of Cement for Enhanced Radiative Cooling and Energy‐Efficient Construction Materials

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
Cement phases are good materials for radiative cooling thanks to the selective emissivity in IR ATW. Cement powders have high reflectance of solar radiation which reduces the thermal losses. The onset of the absorption curves is defined by bound excitons. Sulfates have higher radiated powers and reflectance than calcium silicates.
Jozef Janovec, Guido Goracci, Jorge S. Dolado, Andrés Ayuela   +3 more
wiley   +1 more source

Perspective on Many-Body Methods for Molecular Polaritonic Systems. [PDF]

J Chem Theory Comput
Bauman N, Cunha LA, DePrince AE, Flick J, Foley JJ, Govind N, Groenhof G, Hoffmann N, Kowalski K, Li X, Liebenthal M, Maitra NT, Manderna R, Matoušek M, Mazin IM, Mejia-Rodriguez D, Panyala A, Peng B, Peyton B, Veis L, Vu N, Weidman JD, Wilson AK, Zarotiadis RA, Zhang Y.   +24 more
europepmc   +1 more source

Construction of Sheet‐on‐Hollow Cube Cu2‐xS/ZnIn2S4 p‐n Heterojunction for Enhanced Visible‐Light‐Driven Photocatalytic Hydrogen Production

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
The Cu2–xS/ZnIn2S4 composite photocatalyst is an ultrathin ZnIn2S4 nanosheet in situ grown on the surface of the Cu2–xS hollow cube, forming a unique p‐n junction structure, which exhibits excellent photocatalytic hydrogen production performance under visible light.
Yuan Liu, Jian Yu, Hangang Qiao, Yuhan Zhao, Dongtao Zhang, Xiaojing Chu, Chuanqi Li, Chen Zhu   +7 more
wiley   +1 more source

Quantum vibrational spectroscopy with classical trajectories. [PDF]

Chem Sci
Conte R, Aieta C, Ceotto M.
europepmc   +1 more source

Boosting Photocatalytic H2O2 Synthesis Over HKUST‐1 MOFs‐Derived Hollow HKUST‐1@CuFePBA@CuS Heterojunctions

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
Photoelectron transfer mechanism and photocatalytic O2‐to‐H2O2 reduction process over hollow HS@CuFe@CuS heterojunction photocatalysts. Recently, photocatalytic synthesis of H2O2 has received much attention. However, the photocatalytic activity of photocatalysts is generally limited due to multiple factors, such as insufficiency of photoelectrons, low ...
Xiao Mu, Xiaofeng Sun, Zao Yi, Shifa Wang, Babak Kakavandi, Guorong Liu, Hua Yang   +6 more
wiley   +1 more source

Learning the One-Electron Reduced Density Matrix at SCF Convergence Thresholds. [PDF]

J Chem Theory Comput
Rana B, Viot N, Martinez B JA, Shao X, Ramos P, Pavanello M.   +5 more
europepmc   +1 more source

Enhanced Nonlinear Optical Absorption Properties and Carrier Dynamics of Violet Phosphorene by Oxidation for Ultrafast Photonic Applications

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
This study investigates the effects of oxidation treatment on the nonlinear optical absorption properties and carrier dynamics of two‐dimensional violet phosphorene (VP), elucidating the underlying physical mechanisms. Furthermore, ultrashort laser pulses are achieved utilizing the enhanced saturation absorption and shortened carrier relaxation ...
Bo Li, Han Pan, Qingling Tang, Zhongben Pan, Hongwei Chu, Ying Li, Dechun Li   +6 more
wiley   +1 more source

Modelling electric field control in a 4f molecular qudit with hyperfine coupling. [PDF]

Commun Chem
Morrillo WT, Mattioni A, Blackmore WJA, Mills DP, Chilton NF.   +4 more
europepmc   +1 more source

The Dimensional Revolution of Phosphorus: From Allotropicity to Battery System Applications

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
Phosphorus‐based materials are promising high‐capacity anodes classified by dimension (0D–3D) to systematically explore their properties and composite strategies. When combined with materials such as carbon to form heterostructures, the electrical conductivity and stability are effectively enhanced.
Shuhan Zhang, Zhiyuan Zhang, Ziying Pan, Kaixuan Hu, Yameng Yin, Yapan Wu, Caihong Yang, Lei Zheng, Dongsheng Li   +8 more
wiley   +1 more source