Показ 1 - 20 результатів із 78 для пошуку '"Time Dependent Density Functional Theory"', час виконання запиту: 3.44сек. Уточнити результати
  1. 1
    Tunable plasmons in regular planar arrays of graphene nanoribbons with armchair and zigzag-shaped edges

    Tunable plasmons in regular planar arrays of graphene nanoribbons with armchair and zigzag-shaped edges за авторством Cristian Vacacela Gomez, Michele Pisarra, Mario Gravina, Antonello Sindona

    Опубліковано 2017-01-01
    Предмети:
    Отримати повний текст
    Стаття
  2. 2
    Benchmark Study on Phosphorescence Energies of Anthraquinone Compounds: Comparison between TDDFT and UDFT

    Benchmark Study on Phosphorescence Energies of Anthraquinone Compounds: Comparison between TDDFT and UDFT за авторством Yujie Guo, Lingyu Zhang, Zexing Qu

    Опубліковано 2023-04-01
    Предмети:
    Отримати повний текст
    Стаття
  3. 3
    Computational complexity of time-dependent density functional theory

    Computational complexity of time-dependent density functional theory за авторством J D Whitfield, M-H Yung, D G Tempel, S Boixo, A Aspuru-Guzik

    Опубліковано 2014-01-01
    Предмети: “...time-dependent density functional theory...”
    Отримати повний текст
    Стаття
  4. 4
    Time Evolution of Plasmonic Features in Pentagonal Ag Clusters

    Time Evolution of Plasmonic Features in Pentagonal Ag Clusters за авторством Nicola Domenis, Pablo Grobas Illobre, Margherita Marsili, Mauro Stener, Daniele Toffoli, Emanuele Coccia

    Опубліковано 2023-07-01
    Предмети: “...time-dependent density functional theory...”
    Отримати повний текст
    Стаття
  5. 5
    Si-atoms substitutions effects on the electronic and optical properties of coronene and ovalene

    Si-atoms substitutions effects on the electronic and optical properties of coronene and ovalene за авторством P Mocci, R Cardia, G Cappellini

    Опубліковано 2018-01-01
    Предмети:
    Отримати повний текст
    Стаття
  6. 6
    Simulation of attosecond transient soft x-ray absorption in solids using generalized Kohn–Sham real-time time-dependent density functional theory

    Simulation of attosecond transient soft x-ray absorption in solids using generalized Kohn–Sham real-time time-dependent density functional theory за авторством C D Pemmaraju

    Опубліковано 2020-01-01
    Предмети: “...time-dependent density functional theory...”
    Отримати повний текст
    Стаття
  7. 7
    Nonadiabatic Exchange-Correlation Potential for Strongly Correlated Materials in the Weak and Strong Interaction Limits

    Nonadiabatic Exchange-Correlation Potential for Strongly Correlated Materials in the Weak and Strong Interaction Limits за авторством Volodymyr Turkowski, Talat S. Rahman

    Опубліковано 2022-05-01
    Предмети:
    Отримати повний текст
    Стаття
  8. 8
    The Difference between Plasmon Excitations in Chemically Heterogeneous Gold and Silver Atomic Clusters

    The Difference between Plasmon Excitations in Chemically Heterogeneous Gold and Silver Atomic Clusters за авторством Fanjin Zeng, Lin Long, Shuyi Wang, Xiong Li, Shaohong Cai, Dongxiang Li

    Опубліковано 2024-07-01
    Предмети: “...time-dependent density functional theory...”
    Отримати повний текст
    Стаття
  9. 9
    Application of TD-DFT Theory to Studying Porphyrinoid-Based Photosensitizers for Photodynamic Therapy: A Review

    Application of TD-DFT Theory to Studying Porphyrinoid-Based Photosensitizers for Photodynamic Therapy: A Review за авторством Agnieszka Drzewiecka-Matuszek, Dorota Rutkowska-Zbik

    Опубліковано 2021-11-01
    Предмети:
    Отримати повний текст
    Стаття
  10. 10
    Fluorescence and photophysical properties of xylene isomers in water: with experimental and theoretical approaches

    Fluorescence and photophysical properties of xylene isomers in water: with experimental and theoretical approaches за авторством Muhammad Farooq Saleem Khan, Jing Wu, Bo Liu, Cheng Cheng, Mona Akbar, Yidi Chai, Aisha Memon

    Опубліковано 2018-01-01
    Предмети:
    Отримати повний текст
    Стаття
  11. 11
    Density functional theory studies of solid density plasmas

    Density functional theory studies of solid density plasmas за авторством Hollebon, P

    Опубліковано 2019
    Предмети:
    Дисертація
  12. 12
    Attosecond pulse generation from the interaction of Bromine molecule with bicircularly-polarized laser pulses

    Attosecond pulse generation from the interaction of Bromine molecule with bicircularly-polarized laser pulses за авторством E Irani

    Опубліковано 2019-12-01
    Предмети:
    Отримати повний текст
    Стаття
  13. 13
    Multicomponent synthesis and photophysical study of novel α,β-unsaturated carbonyl depsipeptides and peptoids

    Multicomponent synthesis and photophysical study of novel α,β-unsaturated carbonyl depsipeptides and peptoids за авторством Ricelia González, Juliana Murillo-López, Walter Rabanal-León, Luis Prent-Peñaloza, Odette Concepción, Pedro Olivares, Yorley Duarte, Alexander F. de la Torre, Margarita Gutiérrez, Julio Caballero

    Опубліковано 2023-08-01
    Предмети:
    Отримати повний текст
    Стаття
  14. 14
    Theoretical Studies on Two-Photon Fluorescent Hg2+ Probes Based on the Coumarin-Rhodamine System

    Theoretical Studies on Two-Photon Fluorescent Hg2+ Probes Based on the Coumarin-Rhodamine System за авторством Yujin Zhang, Jiancai Leng

    Опубліковано 2017-07-01
    Предмети:
    Отримати повний текст
    Стаття
  15. 15
    Optical Activity of Spin‐Forbidden Electronic Transitions in Metal Complexes from Time‐Dependent Density Functional Theory with Spin‐Orbit Coupling

    Optical Activity of Spin‐Forbidden Electronic Transitions in Metal Complexes from Time‐Dependent Density Functional Theory with Spin‐Orbit Coupling за авторством Herbert D. Ludowieg, Prof. Monika Srebro‐Hooper, Dr. Jeanne Crassous, Prof. Jochen Autschbach

    Опубліковано 2022-05-01
    Предмети:
    Отримати повний текст
    Стаття
  16. 16
    Far Off Equilibrium Dynamics in Clusters and Molecules

    Far Off Equilibrium Dynamics in Clusters and Molecules за авторством Phuong Mai Dinh, Marc Vincendon, Jordan Heraud, Eric Suraud, Paul-Gerhard Reinhard

    Опубліковано 2020-02-01
    Предмети: “...time-dependent density-functional theory...”
    Отримати повний текст
    Стаття
  17. 17
    Ab Initio Simulation of Attosecond Transient Absorption Spectroscopy in Two-Dimensional Materials

    Ab Initio Simulation of Attosecond Transient Absorption Spectroscopy in Two-Dimensional Materials за авторством Shunsuke A. Sato, Hannes Hübener, Umberto De Giovannini, Angel Rubio

    Опубліковано 2018-09-01
    Предмети:
    Отримати повний текст
    Стаття
  18. 18
    Computational Study of Photodegradation Process and Conversion Products of the Antidepressant Citalopram in Water

    Computational Study of Photodegradation Process and Conversion Products of the Antidepressant Citalopram in Water за авторством Yifan Shen, Se Wang, Ying Lu, Kai Chen, Li Luo, Ce Hao

    Опубліковано 2023-06-01
    Предмети:
    Отримати повний текст
    Стаття
  19. 19
    Exciton Coupling and Conformational Changes Impacting the Excited State Properties of Metal Organic Frameworks

    Exciton Coupling and Conformational Changes Impacting the Excited State Properties of Metal Organic Frameworks за авторством Andreas Windischbacher, Luca Steiner, Ritesh Haldar, Christof Wöll, Egbert Zojer, Anne-Marie Kelterer

    Опубліковано 2020-09-01
    Предмети:
    Отримати повний текст
    Стаття
  20. 20
    Structures and Spectroscopic Properties of Polysulfide Radical Anions: A Theoretical Perspective

    Structures and Spectroscopic Properties of Polysulfide Radical Anions: A Theoretical Perspective за авторством Tristram Chivers, Richard T. Oakley

    Опубліковано 2023-07-01
    Предмети:
    Отримати повний текст
    Стаття

Інструменти для пошуку: