156 results on '"Liang, WanZhen"'
Search Results
2. Vibronic Coupling Effect on Intersystem Crossing Rates of TADF Emitters
3. Identification of the interchromophore interaction in the electronic absorption and circular dichroism spectra of bis-phenanthrenes
4. Origins of the Accelerated Decomposition in Inorganic Tin Perovskites Contaminated by Oxygen: Ab Initio and Quantum Dynamics Study
5. Switching on/off phosphorescent or non‐radiative channels by aggregation‐induced quantum interference
6. Comment on “A posteriori localization of many‐body excited states through simultaneous diagonalization”
7. Electronic Couplings for Singlet Fission Processes Based on the Fragment Particle-Hole Densities
8. Multiscale modeling and simulation of surface‐enhanced spectroscopy and plasmonic photocatalysis
9. Electronic Couplings for Singlet Fission Processes Based on The Fragment Particle-Hole Densities
10. Electronic Couplings for Singlet Fission Processes Based on The Fragment Particle-Hole Densities
11. Unequal Perylene Diimide Twins in a Quadruple Assembly
12. Unequal Perylene Diimide Twins in a Quadruple Assembly
13. Analytical derivative couplings within the framework of time-dependent density functional theory coupled with conductor-like polarizable continuum model: Formalism, implementation, and applications
14. Understanding the Key Roles of pH Buffer in Accelerating Lignin Degradation by Lignin Peroxidase
15. Analytic high-order energy derivatives for metal nanoparticle-mediated infrared and Raman scattering spectra within the framework of quantum mechanics/molecular mechanics model with induced charges and dipoles
16. Substituent Effect on Vibrationally Resolved Absorption Spectra and Exciton Dynamics of Dipyrrolonaphthyridinedione Aggregates
17. Substituent Effect on Vibrationally Resolved Absorption Spectra and Exciton Dynamics of Dipyrrolonaphthyridinedion Aggregates
18. Amplitude Reordering Accelerates the Adaptive Variational Quantum Eigensolver Algorithms
19. Vibronic Coupling Effect on the Vibrationally-Resolved Electronic Spectra and Intersystem Crossing Rates of a TADF Emitter: 7-PhQAD
20. Molecular Design Strategy for Practical Singlet Fission Materials: The Charm of Donor/Acceptor Decorated Quinoidal Structure
21. Amplitude Reordering Accelerates the Adaptive Variational Quantum Eigensolver Algorithms
22. pH Accelerates the Long-Range Electron Transfer for Lignin Degradation via Second-Sphere H-Bonding Interactions
23. Evaluation of molecular photophysical and photochemical properties using linear response time-dependent density functional theory with classical embedding: Successes and challenges
24. Correction to “Vibronic Coupling Effect on the Vibrationally Resolved Electronic Spectra and Intersystem Crossing Rates of a TADF Emitter: 7-PhQA”
25. Gold-Based Double Perovskite-Related Polymorphs: Low Dimensional with an Ultranarrow Bandgap
26. Analytic High-Order Energy Derivatives for Metal Nanoparticle-Mediated Infrared and Raman Scattering Spectra within the Framework of Quantum Mechanics/Molecular Mechanics Model with Induced Charges and Dipoles
27. Vibronic Coupling Effect on the Vibrationally Resolved Electronic Spectra and Intersystem Crossing Rates of a TADF Emitter: 7-PhQAD
28. Exploring the photocatalytic properties and carrier dynamics of 2D Janus XMMX′ (X = S, Se; M = Ga, In; and X′ = Te) materials
29. Influence of intrinsic defects on the structure and dynamics of the mixed Pb–Sn perovskite: first-principles DFT and NAMD simulations
30. H-Type-like Aggregation-Accelerated Singlet Fission Process in Dipyrrolonaphthyridinedione Thin Film: The Role of Charge Transfer/Excimer Mixed Intermediate State
31. Herzberg-Teller Vibronic Coupling Effect on the Vibrationally-Resolved Electronic Spectra and Intersystem Crossing Rates of a TADF Emitter: 7-PhQAD
32. Herzberg-Teller Vibronic Coupling Effect on the Vibrationally-Resolved Electronic Spectra and Intersystem Crossing Rates of a TADF Emitter: 7-PhQAD
33. Understanding the Mechanism of Plasmon-Driven Water Splitting: Hot Electron Injection and Near Field Enhancement Effects
34. Understanding the Mechanism of Plasmon-Driven Water Splitting: Hot Electron Injection and Near Field Enhancement Effects
35. Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
36. Aptamer-based novel Ag-coated magnetic recognition and SERS nanotags with interior nanogap biosensor for ultrasensitive detection of protein biomarker
37. Vibrationally Resolved Absorption Spectra and Exciton Dynamics in Zinc Phthalocyanine Aggregates: Effects of Aggregation Lengths and Remote Exciton Transfer
38. Why Hybrid Tin-Based Perovskites Simultaneously Improve the Structural Stability and Charge Carriers’ Lifetime: Ab Initio Quantum Dynamics
39. Elucidating the Electronic Structure of a Delayed Fluorescence Emitter via Orbital Interactions, Excitation Energy Components, Charge-Transfer Numbers, and Vibrational Reorganization Energies
40. Electronic Couplings for Photoinduced Charge Transfer and Excitation Energy Transfer Based on Fragment Particle–Hole Densities
41. Joint Effects of Exciton–Exciton and Exciton–Photon Couplings on the Singlet Fission Dynamics in Organic Aggregates
42. Nonlinear features of Fano resonance: a QM/EM study
43. Efficient parallel linear scaling method to get the response density matrix in all-electron real-space density-functional perturbation theory
44. Correction: Analysis and visualization of energy densities. I. Insights from real-time time-dependent density functional theory simulations
45. Understanding the Mechanism of Plasmon-Driven Water Splitting: Hot Electron Injection and Near Field Enhancement Effects
46. How the Structures and Properties of Pristine and Anion Vacancy Defective Organic–Inorganic Hybrid Double Perovskites MA2AgIn(BrxI1–x)6 Vary with Br Content x
47. Can We See the Energy Densities? II. Insights from Linear-Response Time-Dependent Density Functional Theory Calculations
48. Can We See the Energy Densities? II. Insights from Linear-Response Time-Dependent Density Functional Theory Calculations
49. Can We See the Energy Densities? I. Insights from Real-Time Time-Dependent Density Functional Theory Simulations
50. Can We See the Energy Densities? I. Insights from Real-Time Time-Dependent Density Functional Theory Simulations
Catalog
Books, media, physical & digital resources
Discovery Service for Jio Institute Digital Library
For full access to our library's resources, please sign in.