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Recent experiments suggest that atomic disordering dynamics are more universal than conventional coherent processes in photoinduced phase transitions (PIPTs), yet its mechanism remains unclear. Using real-time time-dependent density…

Materials Science · Physics 2025-05-07 Wen-Hao Liu , Feng-Wu Guo , Lin-Wang Wang , Jun-Wei Luo

Photoinduced phase transition (PIPT) is always treated as a coherent process, but ultrafast disordering in PIPT is observed in recent experiments. Utilizing the real-time time-dependent density functional theory (rt-TDDFT) method, here, we…

Materials Science · Physics 2022-07-08 Hao-Wen Liu , Wen-Hao Liu , Zhao-Jun Suo , Zhi Wang , Jun-Wei Luo , Shu-Shen Li , Lin-Wang Wang

Ultrafast non-equilibrium dynamics offer a route to study the microscopic interactions that govern macroscopic behavior. In particular, photo-induced phase transitions (PIPTs) in solids provide a test case for how forces, and the resulting…

Photo-induced phase-transitions (PIPTs) driven by highly cooperative interactions are of fundamental interest as they offer a way to tune and control material properties on ultrafast timescales. Due to strong correlations and interactions,…

Materials Science · Physics 2022-11-03 Sangeeta Rajpurohit , Jacopo Simoni , Liang Z. Tan

The transition metal dichalcogenide IrTe2 displays a remarkable series of first-order phase transitions below room temperature, involving lattice displacements as large as 20 percents of the initial bond length. This is nowadays understood…

Strongly Correlated Electrons · Physics 2026-01-30 M. Rumo , G. Kremer , M. Heber , N. Wind , C. W. Nicholson , K. Y. Ma , G. Brenner , F. Pressacco , M. Scholz , K. Rossnagel , F. O. von Rohr , D. Kutnyakhov , C. Monney

Ultrafast photoinduced dynamics of electronic excitation in molecular dimers is drastically affected by the dynamic reorganization of inter- and intra- molecular nuclear configuration modeled by a quantized nuclear degree of freedom [Cina…

Mathematical Physics · Physics 2009-11-10 Dmitri S. Kilin , Yuri V. Pereversev , Oleg V. Prezhdo

We present a time-resolved angle-resolved photoelectron spectroscopy study of IrTe$_2$, which undergoes two first-order structural and charge-ordered phase transitions on cooling below 270 K and below 180 K. The possibility of inducing a…

Strongly Correlated Electrons · Physics 2018-03-14 C. Monney , A. Schuler , T. Jaouen , M. -L. Mottas , Th. Wolf , M. Merz , M. Muntwiler , L. Castiglioni , P. Aebi , F. Weber , M. Hengsberger

The hot carrier cooling occurs in most photoexcitation-induced phase transitions (PIPTs), but its role has often been neglected in many theoretical simulations as well as in proposed mechanisms. Here, by including the previously ignored hot…

Computational Physics · Physics 2021-08-05 Wen-Hao Liu , Jun-Wei Luo , Shu-Shen Li , Lin-Wang Wang

Photo-induced phase transitions (PIPTs) provide an ultrafast, energy-efficient way for precisely manipulating the topological properties of transition-metal ditellurides, and can be used to stabilize a topological phase in an otherwise…

Materials Science · Physics 2020-06-23 Bo Peng , Hao Zhang , Weiwen Chen , Zhi-Jun Qiu , Hezhu Shao , Heyuan Zhu , Bartomeu Monserrat , Desheng Fu , Hongming Weng

Optically induced ultrafast electronic excitations with sufficiently long lifetimes may cause strong effects on phase transitions like structural and nonmetal to metal ones. Examples are transitions diamond to graphite, graphite to…

Materials Science · Physics 2010-09-21 K. H. Bennemann

Molecular dimers are widely utilized as a tool to investigate the structure-property relationships behind the complex photophysical processes of condensed-phase systems, where structural tuning remains a challenge. This approach often…

The dynamics of excitons in disordered molecular solids is studied theoretically, taking into account migration between different sites, recombination, and dissociation into free charge carriers in the presence of an electric field. The…

Condensed Matter · Physics 2009-10-31 M. C. J. M. Vissenberg , M. J. M. de Jong

We theoretically study pump-photon-energy-dependent pathways of a photoinduced dimer-Mott-insulator-to-metal transition, on the basis of numerical solutions to the time-dependent Schr\"odinger equation for the exact many-body wave function…

Strongly Correlated Electrons · Physics 2015-05-28 Kenji Yonemitsu , Satoshi Miyashita , Nobuya Maeshima

We present a theoretical description of femtosecond laser induced dynamics of the hydrogen molecule and of singly ionised sodium dimers, based on a real-space, real-time, implementation of time-dependent density functional theory (TDDFT).…

Condensed Matter · Physics 2007-05-23 Alberto Castro , M. A. L. Marques , Julio A. Alonso , George F. Bertsch , Angel Rubio

We study the phase transition in a system composed of dimers interacting with each other via a nearest-neighbor (NN) exchange $J$ and competing interactions taken from a truncated dipolar coupling. Each dimer occupies a link between two…

Statistical Mechanics · Physics 2013-09-06 Danh-Tai Hoang , Hung T. Diep

The interplay of migration, recombination, and dissociation of excitons in disordered media is studied theoretically in the low temperature regime. An exact expression for the photoluminescence spectrum is obtained. The theory is applied to…

Condensed Matter · Physics 2009-10-28 M. C. J. M. Vissenberg , M. J. M. de Jong

IrTe$_2$ undergoes a series of charge-ordered phase transitions below room temperature that are characterized by the formation of stripes of Ir dimers of different periodicities. Full hemispherical X-ray photoelectron diffraction (XPD)…

Materials Science · Physics 2021-12-15 Maxime Rumo , Aki Pulkkinen , KeYuan Ma , Fabian O. von Rohr , Matthias Muntwiler , Claude Monney

The synchronization of charge oscillations after photoexcitation that has been realized through the emergence of an electronic breathing mode on dimer lattices is studied here from the viewpoint of the competition between interactions and…

Strongly Correlated Electrons · Physics 2020-07-03 Toshiya Shimada , Kenji Yonemitsu

Theories of photoinduced phase transitions have developed along with the progress in experimental studies, especially concerning their nonlinear characters and transition dynamics. At an early stage, paths from photoinduced local structural…

Strongly Correlated Electrons · Physics 2007-05-23 Kenji Yonemitsu , Keiichiro Nasu

Achieving fundamental understanding of insulator-to-metal transitions (IMTs) in strongly correlated systems and their persistent and reversible control via nonequilibrium drive are prime targets of current condensed matter research.…

Strongly Correlated Electrons · Physics 2022-11-29 K. S. Rabinovich , A. N. Yaresko , R. D. Dawson , M. J. Krautloher , T. Priessnitz , Y. -L. Mathis , B. Keimer , A. V. Boris
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