Machine Learning Seams of Conical Intersection: A Characteristic Polynomial Approach (English)
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https://orcid.org/0000-0001-8134-1883
- New search for: Schuurman, Michael S.
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https://orcid.org/0000-0002-0922-9034
- New search for: Wang, Tzu Yu
- New search for: Neville, Simon P.
- Further information on Neville, Simon P.:
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https://orcid.org/0000-0001-8134-1883
- New search for: Schuurman, Michael S.
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https://orcid.org/0000-0002-0922-9034
In:
The Journal of Physical
Chemistry Letters
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14
, 35
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7780-7786
;
2023
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ISSN:
- Article (Journal) / Electronic Resource
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Title:Machine Learning Seams of Conical Intersection: A Characteristic Polynomial Approach
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Additional title:J. Phys. Chem. Lett.
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Contributors:
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Published in:The Journal of Physical Chemistry Letters ; 14, 35 ; 7780-7786
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Publisher:
- New search for: American Chemical Society
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Publication date:2023-09-07
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ISSN:
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Coden:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Licence:
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Source:
Table of contents – Volume 14, Issue 35
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 7780
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Machine Learning Seams of Conical Intersection: A Characteristic Polynomial ApproachWang, Tzu Yu / Neville, Simon P. / Schuurman, Michael S. et al. | 2023
- 7787
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Acid–Base Chemistry of a Model IrO2 Catalytic InterfaceRaman, Abhinav S. / Selloni, Annabella et al. | 2023
- 7795
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Mid-infrared Laser Spectroscopy of Jet-Cooled Formic Acid Trimer: Mode-Dependent Line Broadening in the C–O Stretching RegionNejad, Arman / Li, Xiang / Zhu, Tianxin / Liu, Yun / Duan, Chuanxi et al. | 2023
- 7802
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Nonequilibrium Electrochemical Phase Maps: Beyond Butler–Volmer KineticsKurchin, Rachel C. / Gandhi, Dhairya / Viswanathan, Venkatasubramanian et al. | 2023
- 7808
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The Reactivity-Enhancing Role of Water Clusters in Ammonia Aqueous SolutionsCassone, Giuseppe / Saija, Franz / Sponer, Jiri / Shaik, Sason et al. | 2023
- 7814
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Spin-Crossover and Fragmentation of Fe(neoim)2 on Silver and GoldJohannsen, Sven / Gruber, Manuel / Barreteau, Cyrille / Seredyuk, Maksym / Antonio Real, José / Markussen, Troels / Berndt, Richard et al. | 2023
- 7824
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Magnetic Mode Coupling in Hyperbolic Bowtie Meta-AntennasEbrahimi, Sema / Muravitskaya, Alina / Adawi, Ali M. / Baudrion, Anne-Laure / Adam, Pierre-Michel / Bouillard, Jean-Sebastien G. et al. | 2023
- 7833
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Understanding the Effects of Electrode Material, Single Crystal Facet, and Electrolyte Ion on the Helmholtz Capacitance of Metal/Aqueous Solution InterfacesWang, Xue / Wang, Ying / Kuang, Yongbo / Le, Jia-Bo et al. | 2023
- 7840
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Identification of Material Dimensionality Based on Force Constant AnalysisBagheri, Mohammad / Berger, Ethan / Komsa, Hannu-Pekka et al. | 2023
- 7848
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Probing Water Dissociation and Oxygen Replacement on Partially Oxygen-Covered Cu(111) by Reflection Absorption Infrared SpectroscopySuchodol, Mateusz / Vejayan, Harmina / Zhou, Xueyao / Jiang, Bin / Guo, Hua / Beck, Rainer D. et al. | 2023
- 7854
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Spherulitic Crystallization of CsCu2I3 for High Performance Ultraviolet PhotodetectorsLiu, Wenbo / Li, Mingda / Yang, Chao / Wang, Nana / Huang, Wei / Li, Renzhi / Wang, Jianpu et al. | 2023
- 7860
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Origin of Broad Emission Induced by Rigid Aromatic Ditopic Cations in Low-Dimensional Metal Halide PerovskitesMorana, Marta / Kaiser, Waldemar / Chiara, Rossella / Albini, Benedetta / Meggiolaro, Daniele / Mosconi, Edoardo / Galinetto, Pietro / De Angelis, Filippo / Malavasi, Lorenzo et al. | 2023
- 7869
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Application of a Fluctuating Charge Polarization Model to Large Polyaromatic Hydrocarbons and Graphene NanoflakesMulvey, Devin M. / Jordan, Kenneth D. et al. | 2023
- 7876
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Spin-Flip Unitary Coupled Cluster Method: Toward Accurate Description of Strong Electron Correlation on Quantum ComputersPavošević, Fabijan / Tavernelli, Ivano / Rubio, Angel et al. | 2023
- 7883
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Slip-Enhanced Transport by Graphene in the Microporous Layer for High Power Density Proton-Exchange Membrane Fuel CellsLiu, Ye / Wu, Ningran / Zeng, Haiou / Hou, Dandan / Zhang, Shengping / Qi, Yue / Yang, Ruizhi / Wang, Luda et al. | 2023
- 7892
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Disorder and Photogeneration Efficiency in Organic SemiconductorsToropin, Artem V. / Nikitenko, Vladimir R. / Korolev, Nikolai A. / Prezhdo, Oleg V. et al. | 2023
- 7897
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Triplet Formation in a 9,10-Bis(phenylethynyl)anthracene Dimer and Trimer Occurs by Charge Recombination Rather than Singlet FissionRingström, Rasmus / Schroeder, Zachary W. / Mencaroni, Letizia / Chabera, Pavel / Tykwinski, Rik R. / Albinsson, Bo et al. | 2023
- 7903
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Ionic Solvent-Assisted MAPbBr3 Perovskite Film for Two-Photon Pumped Single-Mode LaserZhan, Zijun / Hu, Zhiping / Huang, Sihao / Dong, Siyu / Li, Qian / Liu, Zhengzheng / Du, Juan / Leng, Yuxin et al. | 2023
- 7910
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Machine-Learning Solutions for the Analysis of Single-Particle Diffusion TrajectoriesSeckler, Henrik / Szwabiński, Janusz / Metzler, Ralf et al. | 2023
- 7924
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Atomic Positional Embedding-Based Transformer Model for Predicting the Density of States of Crystalline MaterialsCui, Yaning / Chen, Kang / Zhang, Lingyao / Wang, Haotian / Bai, Lei / Elliston, David / Ren, Wei et al. | 2023
- 7931
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Nonequilibrium Magneto-Conductance as a Manifestation of Spin Filtering in Chiral NanojunctionsGarcía-Blázquez, M. A. / Dednam, W. / Palacios, J. J. et al. | 2023
- 7940
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Elucidating the Self-cleavage Dynamics of Hairpin Ribozyme by Mode-decomposed Infrared SpectroscopyGulzar, Adnan / Noetzel, Jan / Forbert, Harald / Marx, Dominik et al. | 2023
- 7946
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Charge-Transfer-Driven Phase Transition of Two-Dimensional MoTe2 in Donor–Acceptor HeterostructuresYu, Shiqiang / Dai, Ying / Huang, Baibiao / Wei, Wei et al. | 2023
- 7953
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Revealing Charge-Transfer Dynamics at Buried Charge-Selective Heterointerface in Highly Effective Perovskite Solar CellsLi, Di / Xiong, Shaobing / Peng, Bo / Liu, Weimin / Li, Bo / Bao, Qinye et al. | 2023
- 7960
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Structure-Resolved Monitoring of Single-Wall Carbon Nanotube Functionalization from Raman Intermediate Frequency ModesSoltani, Nima / Zheng, Yu / Bachilo, Sergei M. / Weisman, R. Bruce et al. | 2023
- 7967
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Origin of Energy Dissipation in the Oligomeric Fucoxanthin-Chlorophyll a/c Binding ProteinsZheng, Mengyuan / Zhou, Cuicui / Wang, Wenda / Kuang, Tingyun / Shen, Jianren / Tian, Lijin et al. | 2023
- 7975
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Tunable Intrinsic Phonon Mode versus Anomalous Thermal Transport in Two-Dimensional Strongly Anharmonic Group IB Chalcogenides A2 IB Se1/2Te1/2 (A IB = Cu, Ag, or Au)Yu, Jinzi / Zhou, Ran / Shi, Hongliang / Duan, Yifeng et al. | 2023