Results 181 to 190 of about 743,578 (322)

Rational Design of Donor‐Acceptor Oligomers for Enhanced Charge Separation

Advanced Physics Research, EarlyView.
How can molecular symmetry be broken to maximize photoinduced charge separation? Through first‐principles analysis of 22 DTP‐based donor‐acceptor ternary oligomers, this work establishes that combining architectural asymmetry with site‐selective acceptor fluorination creates an ideal electrostatic landscape for frontier orbital segregation.
Jannik Theile, Michele Guerrini, Surender Kumar, Caterina Cocchi   +3 more
wiley   +1 more source

<i>n</i>-Mode Quantized Anharmonic Vibronic Hamiltonians for Matrix Product State Dynamics. [PDF]

J Chem Theory Comput
Barandun V, Glaser N, Reiher M.
europepmc   +1 more source

Interconnection and damping assignment passivity-based control of port-controlled Hamiltonian systems

at - Automatisierungstechnik, 2002
R. Ortega, A. Schaft, B. Maschke, G. Escobar   +3 more
semanticscholar   +1 more source

The Progress of Orbitronics: The Enhancement of Orbital Torque Efficiency

Advanced Physics Research, EarlyView.
Orbit‐torque (OT) devices attract significant attention for their low‐power consumption and high stability in applications. This review systematically outlines strategies for enhancing OT efficiency. We categorize approaches into boosting orbital currents/torques and improving the orbital‐to‐spin conversion coefficient.
Pengfei Liu, Tianci Tong, Delin Zhang, Tian Wang, Xinze Li, Ping Wang, Yong Jiang   +6 more
wiley   +1 more source

Lossless and Lossy Characterization of the State of Perturbed Anharmonic Diatomics: An Information-Theoretic Compaction of Quantum Dynamics. [PDF]

J Chem Theory Comput
Hamilton JR, Levine RD.
europepmc   +1 more source

Quasi Hamiltonian semigroups [PDF]

Czechoslovak Mathematical Journal, 1983
CHERUBINI, ALESSANDRA, VARISCO, ADA
openaire   +3 more sources

Regional Shopping Objectives in British Grocery Retail Transactions Using Segmented Topic Models

Applied Stochastic Models in Business and Industry, EarlyView.
ABSTRACT Understanding the customer behaviours behind transactional data has high commercial value in the grocery retail industry. Customers generate millions of transactions every day, choosing and buying products to satisfy specific shopping needs.
Mariflor Vega Carrasco, Mirco Musolesi, Jason O'Sullivan, Rosie Prior, Ioanna Manolopoulou   +4 more
wiley   +1 more source

Hamiltonian Dynamics [PDF]

, 2001
openaire   +2 more sources

Single‐Atom‐Dispersed FeNC/FeS2 Nanocluster for High‐Performance Sodium Metal Battery With Hybrid Electrochemical Behavior

Carbon Energy, EarlyView.
A novel single‐atom‐dispersed S2–FeNC/FeS2 nanocluster heterojunction with unique hybrid electrochemical behavior for suppressing the shuttle effect and promoting the hybrid electrochemical reaction was designed, thus improving the specific capacity and cycling stability.
Yuan Liu, Geng Li, Shunxian Yu, Xinran Qi, Zhuang‐Chun Jian, Wei Zhan, Baoxiu Hou, Shuming Zeng, Hui Shao, Jianjun Song, Yao Xiao, Xiaoxian Zhao   +11 more
wiley   +1 more source

Exploring the Boundaries of Modern Quantum Annealers with RNA Structure Prediction. [PDF]

J Phys Chem B
Andrews B, Abraham J, Fox D, Radja A.
europepmc   +1 more source