Results 211 to 220 of about 25,652 (291)

Luminescence Spectra Simulation of Ce3+‐Activated Phosphors by Accumulating Emission Lines Along First‐Principles Molecular Dynamics Trajectories

Advanced Theory and Simulations, Volume 9, Issue 6, June 2026.
A density functional theory‐based method is introduced to predict the luminescence emission spectra of candidate compounds, including broadening caused by atomic thermal motion. For each snapshot from the molecular dynamics of the Ce‐activated system using the excited‐state electron configuration, the transition energies and probabilities are ...
Satoru Matsuishi, Hidekazu Ikeno, Yukinori Koyama, Takashi Takeda   +3 more
wiley   +1 more source

Oscillator-qubit generalized quantum signal processing: a case study of the uracil cation vibronic model. [PDF]

Chem Sci
Hong J, Kim SH, Min SK, Huh J.
europepmc   +1 more source

Noise Spectroscopy of Cavity Polaritons

Advanced Theory and Simulations, Volume 9, Issue 6, June 2026.
Advancements in experimental techniques at the nanoscale have given rise to the field of molecular polaritonics. Recent developments report simultaneous measurement of conductance and electroluminescence in such systems. A theoretical method for simulating electron and photon fluxes and noise in open molecular polaritonic systems is formulated by ...
Upendra Harbola, Michael Galperin
wiley   +1 more source

Unraveling the Relevant Length and Time Scales of Elastomers in a High Strain Rate Test. [PDF]

Macromolecules
Evans KM, Baird DA, Centellas PJ, Soles CL, Chan EP.   +4 more
europepmc   +1 more source

Energy‐Resolved Femtosecond Dynamics of Plasmon‐Induced Hole Injection at Au/GaN Heterointerfaces

Advanced Science, Volume 13, Issue 33, 15 June 2026.
We reveal the spectral signature of ultrafast nonthermal hot‐hole transfer at plasmonic heterointerfaces, which reshapes hot‐carrier relaxation dynamics and significantly enhances hydrogen evolution, providing a mechanistic basis for optimizing hot‐carrier utilization in photocatalysis.
Yuying Gao, Yuxin Xie, Jonathan Diederich, Christian Höhn, Klaus Schwarzburg, Fengtao Fan, Can Li, Roel van de Krol, Dennis Friedrich   +8 more
wiley   +1 more source

A First-Principles Thermodynamic Uncertainty Relation for Shortcuts to Adiabaticity. [PDF]

Entropy (Basel)
Perna GE, Centrone F, Calzetta E.
europepmc   +1 more source

Progress in Strain Engineering of 2D‐Integrated Heterostructures for Ultrasensitive Sensors

Advanced Science, Volume 13, Issue 33, 15 June 2026.
 . ABSTRACT Two‐dimensional (2D) integrated heterostructures have emerged as a cornerstone in the advancement of next‐generation sensor technologies. These heterostructures, which combine materials with different dimensionalities, have led to significant breakthroughs in sensing performance and device integration.
That Buu Ton, Tuan Sang Tran, Duc Khanh Tran, Van Thanh Dau, Dzung Viet Dao   +4 more
wiley   +1 more source

Analytical solution of driven time-dependent mesoscopic circuits. [PDF]

Sci Rep
Ma J, Yao Y, Liu R, Qiu F, Zhang X, Yan Z.   +5 more
europepmc   +1 more source

A Hybrid Semi‐Inverse Variational and Machine Learning Approach for the Schrödinger Equation

Advanced Physics Research, Volume 5, Issue 6, June 2026.
A hybrid semi‐inverse variational and machine‐learning framework is presented for solving the Schrödinger equation with complex quantum potentials. Physics‐based variational solutions generate high‐quality training data, enabling Random Forest and Neural Network models to deliver near‐perfect energy predictions.
Khalid Reggab, Houssam Eddine Hailouf, Kingsley Onyebuchi Obodo, Mireille Megnidio‐Tchoukouegno, Mohammed Benali Kanoun, Souraya Goumri‐Said   +5 more
wiley   +1 more source

<i>PyCycleBio</i>: modelling non-sinusoidal-oscillator systems in temporal biology. [PDF]

Bioinform Adv
Bennett AR, Birchenough G, Bojar D.
europepmc   +1 more source