Journal articles on the topic 'Non-adiabatic state transfer'
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Dommett, Michael, and Rachel Crespo-Otero. "Excited state proton transfer in 2′-hydroxychalcone derivatives." Physical Chemistry Chemical Physics 19, no. 3 (2017): 2409–16. http://dx.doi.org/10.1039/c6cp07541j.
ZHEN, YIN. "DYNAMIC THEORY OF ELECTRON TRANSFER PROCESS." Modern Physics Letters B 02, no. 05 (June 1988): 743–52. http://dx.doi.org/10.1142/s0217984988000448.
Reimers, Jeffrey R., and Noel S. Hush. "The critical role of the transition-state cusp diameter in understanding adiabatic and non-adiabatic electron transfer." Russian Journal of Electrochemistry 53, no. 9 (September 2017): 1042–53. http://dx.doi.org/10.1134/s1023193517090105.
Fewell, M. P., B. W. Shore, and K. Bergmann. "Coherent Population Transfer among Three States: Full Algebraic Solutions and the Relevance of Non Adiabatic Processes to Transfer by Delayed Pulses." Australian Journal of Physics 50, no. 2 (1997): 281. http://dx.doi.org/10.1071/p96071.
Chen, Wen-Kai, Ganglong Cui, and Xiang-Yang Liu. "Solvent effects on excited-state relaxation dynamics of paddle-wheel BODIPY-Hexaoxatriphenylene conjugates: Insights from non-adiabatic dynamics simulations." Chinese Journal of Chemical Physics 35, no. 1 (February 2022): 117–28. http://dx.doi.org/10.1063/1674-0068/cjcp2110214.
Cina, Jeffrey A. "Dynamics of an excitation-transfer trimer: Interference, coherence, Berry’s phase development, and vibrational control of non-adiabaticity." Journal of Chemical Physics 158, no. 12 (March 28, 2023): 124307. http://dx.doi.org/10.1063/5.0139174.
Yan, B. H., Han Yang Gu, Y. H. Yang, and L. Yu. "CFD Analysis of Turbulent Flow in Typical Rod Bundles in Rolling Motion." Applied Mechanics and Materials 29-32 (August 2010): 716–24. http://dx.doi.org/10.4028/www.scientific.net/amm.29-32.716.
Lane-Serff, G. F., and S. D. Sandbach. "Emptying non-adiabatic filling boxes: the effects of heat transfers on the fluid dynamics of natural ventilation." Journal of Fluid Mechanics 701 (May 23, 2012): 386–406. http://dx.doi.org/10.1017/jfm.2012.164.
Schumer, A., Y. G. N. Liu, J. Leshin, L. Ding, Y. Alahmadi, A. U. Hassan, H. Nasari, et al. "Topological modes in a laser cavity through exceptional state transfer." Science 375, no. 6583 (February 25, 2022): 884–88. http://dx.doi.org/10.1126/science.abl6571.
Fernandez-Alberti, Sebastian, Dmitry V. Makhov, Sergei Tretiak, and Dmitrii V. Shalashilin. "Non-adiabatic excited state molecular dynamics of phenylene ethynylene dendrimer using a multiconfigurational Ehrenfest approach." Physical Chemistry Chemical Physics 18, no. 15 (2016): 10028–40. http://dx.doi.org/10.1039/c5cp07332d.
Abuaf, N., R. Bunker, and C. P. Lee. "Heat Transfer and Film Cooling Effectiveness in a Linear Airfoil Cascade." Journal of Turbomachinery 119, no. 2 (April 1, 1997): 302–9. http://dx.doi.org/10.1115/1.2841113.
Szabla, Rafał, Robert W. Góra, Mikołaj Janicki, and Jiří Šponer. "Photorelaxation of imidazole and adenine via electron-driven proton transfer along H2O wires." Faraday Discussions 195 (2016): 237–51. http://dx.doi.org/10.1039/c6fd00131a.
Jankowska, Joanna, Mario Barbatti, Joanna Sadlej, and Andrzej L. Sobolewski. "Tailoring the Schiff base photoswitching – a non-adiabatic molecular dynamics study of substituent effect on excited state proton transfer." Physical Chemistry Chemical Physics 19, no. 7 (2017): 5318–25. http://dx.doi.org/10.1039/c6cp08545h.
Wang, Yue, Ting Wang, and Xing-Yu Zhu. "Virtual Photon-Mediated Quantum State Transfer and Remote Entanglement between Spin Qubits in Quantum Dots Using Superadiabatic Pulses." Entropy 26, no. 5 (April 29, 2024): 379. http://dx.doi.org/10.3390/e26050379.
Leyva, Verónica, Inés Corral, Ferran Feixas, Annapaola Migani, Lluís Blancafort, Jesús González-Vázquez, and Leticia González. "A non-adiabatic quantum-classical dynamics study of the intramolecular excited state hydrogen transfer in ortho-nitrobenzaldehyde." Physical Chemistry Chemical Physics 13, no. 32 (2011): 14685. http://dx.doi.org/10.1039/c1cp20620f.
Jiang, Mei Ling, Min Wang, and Dong Chen. "The Overview of Modeling the Thermo-Mechanical Three Dimensional Friction Stir Welding Process." Advanced Materials Research 189-193 (February 2011): 2129–33. http://dx.doi.org/10.4028/www.scientific.net/amr.189-193.2129.
Tang, Hui, GeonHwan Cho, Mario Patinios, James A. Scobie, Carl M. Sangan, J. Michael Owen, and Gary D. Lock. "Effect of Ingress on Flow and Heat Transfer Upstream and Downstream of a Rotating Turbine Disc." Aerospace 6, no. 5 (April 26, 2019): 49. http://dx.doi.org/10.3390/aerospace6050049.
Sara Bensilakhal, Redha Rebhi, Noureddine Hadidi, Giulio Lorenzini, Yacine Kerchiche, Younes Menni, Houari Ameur, and Hijaz Ahmad. "Bi-stability Bifurcation in Convection Double Diffusion Through a Shallow Horizontal Layer Saturated with a Complex Fluid." Journal of Advanced Research in Fluid Mechanics and Thermal Sciences 101, no. 1 (January 18, 2023): 137–59. http://dx.doi.org/10.37934/arfmts.101.1.137159.
Alsabery, Ammar I., Ishak Hashim, Ali J. Chamkha, Habibis Saleh, and Bilal Chanane. "Effect of spatial side-wall temperature variation on transient natural convection of a nanofluid in a trapezoidal cavity." International Journal of Numerical Methods for Heat & Fluid Flow 27, no. 6 (June 5, 2017): 1365–84. http://dx.doi.org/10.1108/hff-11-2015-0488.
Spencer, Jacob, Laura Scalfi, Antoine Carof, and Jochen Blumberger. "Confronting surface hopping molecular dynamics with Marcus theory for a molecular donor–acceptor system." Faraday Discussions 195 (2016): 215–36. http://dx.doi.org/10.1039/c6fd00107f.
Hänni, Dominic, Rainer Schädler, Reza Abhari, Anestis Kalfas, Gregor Schmid, Ewald Lutum, and Nicolas Lecoq. "Purge flow effects on rotor hub endwall heat transfer with extended endwall contouring into the disk cavity." Journal of the Global Power and Propulsion Society 3 (May 13, 2019): 555–68. http://dx.doi.org/10.33737/jgpps/109838.
Basilevsky, M. V., M. V. Vener, G. V. Davidovich, and A. V. Soudackov. "Dynamics of proton transfer reactions in polar solvent in the non-adiabatic two-state approximation: test calculations for carbon-carbon reaction centre." Chemical Physics 208, no. 2 (August 1996): 267–82. http://dx.doi.org/10.1016/0301-0104(96)00058-4.
Fatima, Jon Vogel, Talgat Inerbaev, Nuri Oncel, and Dmitri Kilin. "First-Principles Study of Charge Carrier Dynamics with Explicit Treatment of Momentum Dispersion on Si Nanowires along <211> crystallographic Directions." MRS Advances 3, no. 59 (2018): 3477–82. http://dx.doi.org/10.1557/adv.2018.560.
Wolfrum, J. "Laser Stimulation and Observation of Simple Gas Phase Radical Reactions." Laser Chemistry 9, no. 1-3 (January 1, 1988): 171–93. http://dx.doi.org/10.1155/lc.9.171.
Boccelli, Stefano, and James G. McDonald. "Realizability conditions for relativistic gases with a non-zero heat flux." Physics of Fluids 34, no. 9 (September 2022): 097115. http://dx.doi.org/10.1063/5.0106214.
Knuth, Shelley L., and John J. Cassano. "Estimating Sensible and Latent Heat Fluxes Using the Integral Method from in situ Aircraft Measurements." Journal of Atmospheric and Oceanic Technology 31, no. 9 (September 1, 2014): 1964–81. http://dx.doi.org/10.1175/jtech-d-14-00008.1.
Richings, Gareth W., and Scott Habershon. "Analyzing Grid-Based Direct Quantum Molecular Dynamics Using Non-Linear Dimensionality Reduction." Molecules 26, no. 24 (December 7, 2021): 7418. http://dx.doi.org/10.3390/molecules26247418.
Freibert, Antonia, David Mendive-Tapia, Nils Huse, and Oriol Vendrell. "Femtosecond x-ray absorption spectroscopy of pyrazine at the nitrogen K-edge: on the validity of the Lorentzian limit." Journal of Physics B: Atomic, Molecular and Optical Physics 54, no. 24 (December 22, 2021): 244003. http://dx.doi.org/10.1088/1361-6455/ac3846.
de la Lande, Aurélien, Aurelio Alvarez-Ibarra, Karim Hasnaoui, Fabien Cailliez, Xiaojing Wu, Tzonka Mineva, Jérôme Cuny, et al. "Molecular Simulations with in-deMon2k QM/MM, a Tutorial-Review." Molecules 24, no. 9 (April 26, 2019): 1653. http://dx.doi.org/10.3390/molecules24091653.
Alsharari, Fahad, and Mohamed M. Mousa. "New application of MOL-PACT for simulating buoyancy convection of a copper-water nanofluid in a square enclosure containing an insulated obstacle." AIMS Mathematics 7, no. 11 (2022): 20292–312. http://dx.doi.org/10.3934/math.20221111.
Diao, Li, and Peter Wan. "Chemistry of photogenerated α-phenyl-substituted o-, m-, and p-quinone methides from phenol derivatives in aqueous solution." Canadian Journal of Chemistry 86, no. 2 (February 1, 2008): 105–18. http://dx.doi.org/10.1139/v07-125.
Karwowski, Boleslaw. "How Clustered DNA Damage Can Change the Electronic Properties of ds-DNA—Differences between GAG, GAOXOG, and OXOGAOXOG." Biomolecules 13, no. 3 (March 11, 2023): 517. http://dx.doi.org/10.3390/biom13030517.
Pagliarini, L., F. Clemens, F. Bozzoli, L. Cattani, N. Miche, M. Bernagozzi, M. Marengo, A. A. Alqahtani, and V. Bertola. "Infrared measurements of fluid temperature in a polymeric Pulsating Heat Pipe." Journal of Physics: Conference Series 2685, no. 1 (January 1, 2024): 012050. http://dx.doi.org/10.1088/1742-6596/2685/1/012050.
Camci, C., and B. Glezer. "Liquid Crystal Thermography on the Fluid Solid Interface of Rotating Systems." Journal of Heat Transfer 119, no. 1 (February 1, 1997): 20–29. http://dx.doi.org/10.1115/1.2824095.
Farjallah, Mohamed, Dibyendu Sardar, Bimalendu Deb, and Hamid Berriche. "Electronic Structure, Spectroscopy, Cold Ion–Atom Elastic Collision Properties, and Photoassociation Formation Prediction of the (MgCs)+ Molecular Ion." Atoms 11, no. 9 (September 15, 2023): 121. http://dx.doi.org/10.3390/atoms11090121.
Dutta Pal, Gopa, Bipan Dutta, Tapan Ganguly, and Joydeep Chowdhury. "Role of gold nanocolloids on the photostability of 2-hydroxy-5-methyl benzaldehyde molecule and evidence of excited state intramolecular proton transfer process aided by DFT, non-adiabatic Ab Initio molecular dynamics simulations." Journal of Luminescence 188 (August 2017): 378–87. http://dx.doi.org/10.1016/j.jlumin.2017.04.038.
Karwowski, Boleslaw T. "The Influence of Oxidized Imino-Allantoin in the Presence of OXOG on Double Helix Charge Transfer: A Theoretical Approach." International Journal of Molecular Sciences 25, no. 11 (May 29, 2024): 5962. http://dx.doi.org/10.3390/ijms25115962.
Wang, Yifan, Sai Vudata, Paul Brooker, and James M. Fenton. "(Digital Presentation) Integration of Renewable Hydrogen Production, Compression and Storage for Mobile and Stationary Fuel Cells." ECS Meeting Abstracts MA2022-01, no. 39 (July 7, 2022): 1733. http://dx.doi.org/10.1149/ma2022-01391733mtgabs.
Lazzi Gazzini, Sebastiano, Rainer Schädler, Anestis I. Kalfas, Reza S. Abhari, Sebastian Hohenstein, Gregor Schmid, and Ewald Lutum. "Effect of purge air on rotor endwall heat transfer of an axial turbine." Journal of the Global Power and Propulsion Society 1 (October 12, 2017): F29ZWY. http://dx.doi.org/10.22261/f29zwy.
SHARAFUTDINOV, Ramil F., and Filyus F. Davletshin. "AN ANALYTICAL MODEL OF A NON-STATIONARY TEMPERATURE FIELD IN A RESERVOIR WITH A HYDRAULIC FRACTURING." Tyumen State University Herald. Physical and Mathematical Modeling. Oil, Gas, Energy 7, no. 2 (2021): 75–94. http://dx.doi.org/10.21684/2411-7978-2021-7-2-75-94.
POPE, ALLEN, IAN C. WILLIS, FINNUR PÁLSSON, NEIL S. ARNOLD, W. GARETH REES, HELGI BJÖRNSSON, and LAUREN GREY. "Elevation change, mass balance, dynamics and surging of Langjökull, Iceland from 1997 to 2007." Journal of Glaciology 62, no. 233 (April 18, 2016): 497–511. http://dx.doi.org/10.1017/jog.2016.55.
Cerezo, Javier, Sheng Gao, Nicola Armaroli, Francesca Ingrosso, Giacomo Prampolini, Fabrizio Santoro, Barbara Ventura, and Mariachiara Pastore. "Non-Phenomenological Description of the Time-Resolved Emission in Solution with Quantum–Classical Vibronic Approaches—Application to Coumarin C153 in Methanol." Molecules 28, no. 9 (May 5, 2023): 3910. http://dx.doi.org/10.3390/molecules28093910.
Wu, JiaHui, Xiaohang Chen, Shu-Hua Xia, Ganglong Cui, and Yan Zhang. "Excited-state Photochemistry Dynamics of 2-(1-naphthyl) phenol: Electronic Structure Calculations and Non-adiabatic Dynamics Simulations." Physical Chemistry Chemical Physics, 2022. http://dx.doi.org/10.1039/d2cp03283j.
Ferté, Anthony, Axel Houssin, Nina Albouy, Isabella C. D. Merritt, and Morgane Vacher. "ESIPT in the Pyrrol Pyridine molecule: Mechanism, timescale and yield revealed using dynamics simulations." Physical Chemistry Chemical Physics, 2023. http://dx.doi.org/10.1039/d3cp00026e.
Bennett, Olivia, Antonia Freibert, K. Eryn Spinlove, and Graham A. Worth. "Prediction through quantum dynamics simulations: Photo-excited cyclobutanone." Journal of Chemical Physics 160, no. 17 (May 1, 2024). http://dx.doi.org/10.1063/5.0203654.
Fay, Thomas P. "Extending non-adiabatic rate theory to strong electronic couplings in the Marcus inverted regime." Journal of Chemical Physics 161, no. 1 (July 1, 2024). http://dx.doi.org/10.1063/5.0218653.
Shen, Yuan, Giampiero Marchegiani, Gianluigi Catelani, Luigi Amico, Ai Qun Liu, Weijun Fan, and Leong Chuan Kwek. "GHZ-like states in the Qubit-Qudit Rabi model." SciPost Physics 11, no. 6 (December 1, 2021). http://dx.doi.org/10.21468/scipostphys.11.6.099.
Lognon, Elise, Alain Burger, Elise Dumont, and Antonio Monari. "Effect of Microhydration in Tuning the Photophysical Behavior of a Luminescent DNA Probe Revealed by Non‐Adiabatic Dynamics." ChemPhotoChem, April 17, 2024. http://dx.doi.org/10.1002/cptc.202400078.
Chen, Zhao-Xian, Yu-Gui Peng, Ze-Guo Chen, Yuan Liu, Peng Chen, Xue-Feng Zhu, and Yan-Qing Lu. "Robust temporal adiabatic passage with perfect frequency conversion between detuned acoustic cavities." Nature Communications 15, no. 1 (February 17, 2024). http://dx.doi.org/10.1038/s41467-024-45932-6.
Quashie, Edwin E., Xavier Andrade, and Alfredo A. Correa. "Directional dependency of electronic stopping in nickel, projectile’s excited charge state and momentum transfer." European Physical Journal D 75, no. 11 (October 29, 2021). http://dx.doi.org/10.1140/epjd/s10053-021-00266-6.