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20 积分 2024-10-07 加入
Design and computational analysis of nitrobenzofurazan-based non-fullerene acceptors for organic solar cells: A DFT and molecular dynamics simulation study
2个月前
已完结
Rational Design and Theoretical Investigation of Quinoxaline‐Based Small‐Molecule Functional Materials for High‐Performance Organic Solar Cells
2个月前
已完结
The end-group iodination effects of non-fullerene acceptor on organic photovoltaics
3个月前
已完结
Energetic inversion of singlet/triplet interfacial charge-transfer states for reduced energy loss in organic solar cells
3个月前
已完结
Efficient and Accurate Estimation of Electronic Polarization Energies for Organic Semiconductors: An Embedding Charge Quantum Mechanics/Continuum Dielectric Model
3个月前
已完结
Quantitative analysis of the electrostatic and electronic polarization energies in molecularly mixed films of organic semiconductors
3个月前
已完结
Tunable dual type-I and type-II Weyl points in the Dirac-Weyl semimetal CaAgBi
3个月前
已完结
Theoretical exploration of diverse electron-deficient core and terminal groups in A–DA′D–A type non-fullerene acceptors for organic solar cells
3个月前
已完结
Improving Small-Molecules Based OSCs Performance Through Molecular Optimization: A Computational DFT Analysis
3个月前
已关闭
Unveiling additive effects on molecular packing and charge transfer in organic solar cells: an AIMD and DFT study
3个月前
已完结
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