Results 61 to 70 of about 2,542 (183)

Symmetry‐Restricted Energy Landscapes as a Benchmark for Machine Learned Interatomic Potentials

Advanced Theory and Simulations, Volume 9, Issue 8, August 2026.
We present a benchmark for assessing the physical accuracy of machine‐learned interatomic potentials. By constructing two‐dimensional potential energy surface slices along symmetry‐allowed degrees of freedom and comparing them with DFT, the benchmark reveals model strengths, weaknesses, and artifacts, providing an easily interpretable test of energy ...
Abhijith S. Parackal, Rickard Armiento, Florian Trybel   +2 more
wiley   +1 more source

The Pressure Response of Bulk and Two−Dimensional MoS₂ Crystals Studied by Raman and Photoluminescence Spectroscopy: Dimensionality and Pressure Transmitting Medium Effects

Crystals
The pressure response of bulk and two−dimensional (2D) MoS2 crystals (monolayer, bilayer, and many–layered), directly transferred to the diamond surface of the diamond anvil cell (DAC) used for high−pressure application, is examined by means of Raman and
Niki Sorogas, Krystallis Tersis, Antonios Michail, Sotirios Ves, Konstantinos Papagelis, Dimitrios Christofilos, John Arvanitidis   +6 more
doaj   +1 more source

Fundamentals of Thermal Transport and Energy Conversion in Ultra‐High Temperature Ceramics: From Microscale Mechanisms to Macroscopic Properties

Advanced Science, Volume 13, Issue 47, 24 August 2026.
This review critically examines thermal transport and radiative properties of ultra‐high temperature ceramics for hypersonic flight, advanced nuclear systems, and next‐generation energy conversion devices. It explores phonon–photon–electron interactions, microstructural engineering, thermoelectric conversion, and machine learning‐accelerated multiscale
Zhipeng Pei, Yue Li, Jiayu Xing, Yue Zhu, Ru Zhang, Huan Wu, Zihao Qin, Gang Pei, Man Li   +8 more
wiley   +1 more source

Portable laser-heating system for diamond anvil cells

Journal of Synchrotron Radiation, 2009
The diamond anvil cell (DAC) technique coupled with laser heating has become the most successful method for studying materials in the multimegabar pressure range at high temperatures. However, so far all DAC laser-heating systems have been stationary: they are linked either to certain equipment or to a beamline.
L, Dubrovinsky, K, Glazyrin, C, McCammon, O, Narygina, E, Greenberg, S, Ubelhack, A I, Chumakov, S, Pascarelli, V, Prakapenka, J, Bock, N, Dubrovinskaia   +10 more
openaire   +2 more sources

Outstanding TC Enhancement in 5d–3d Y2NiIrO6 by Compression

Advanced Science, Volume 13, Issue 45, 13 August 2026.
Double perovskite Y2NiIrO6 with half filed 3d eg–5d t2g configuration, exhibits first experimental example of pressure‐enhanced magnetic interaction in iridate and iridate‐related systems. Its Curie temperature increase from 192 to 243 K at 17 GPa. Herein, the orthogonal eg–t2g pathway remains robust even under compression‐induced lattice distortion ...
Zheng Deng, Yao Zhang, Sijia Zhang, Jing Song, Wanli He, Yuanzhe Li, Meilin Jin, Xiang Li, Guanghua Liu, Zhen Dong, Jingkai Bi, Wenmin Li, Jianfa Zhao, Jun Zhang, Yi Peng, Luchuan Shi, Junling Meng, Xiancheng Wang, Changqing Jin   +18 more
wiley   +1 more source

Development of micro-XANES mapping in the diamond anvil cell

Journal of Synchrotron Radiation, 2009
Energy-dispersive X-ray absorption spectroscopy is now a well established method that has been applied to a broad range of applications. At the energy-dispersive EXAFS beamline of the ESRF, ID24, the recently achieved 5 x 5 microm focal spot combined with fast acquisition has allowed complex and non-uniform samples to be mapped and images to be ...
Aquilanti, Giuliana, Pascarelli, Sakura, Mathon, Olivier, Muñoz, Manuel, Narygina, Olga, Dubrovinsky, Leonid   +5 more
openaire   +4 more sources

Tensorial stress-plastic strain fields in α - ω Zr mixture, transformation kinetics, and friction in diamond-anvil cell. [PDF]

Nat Commun, 2023
Levitas VI, Dhar A, Pandey KK.
europepmc   +1 more source

Pressure‐Driven Phase Transition Unlocking Unique Eu2+ Luminescence in Li2SrSiO4 for Optical Sensing and White‐LEDs

Advanced Science, Volume 13, Issue 47, 24 August 2026.
This study demonstrates, for the first time, the use of a large‐format high‐pressure press to modify synthesized Li2SrSiO4:Eu2+,Cs+ phosphors after its preparation. The pressure treatment results in the formation of new materials with distinctive optical properties, opening pathways for the development of advanced LED devices and high‐performance ...
Przemysław Woźny, Peng Du, Teng Zheng, Junpeng Xue, Liang Peng, Shuailing Ma, Szymon Sobczak, Victor Lavín, Tian Cui, Marcin Runowski   +9 more
wiley   +1 more source

A MHz X-ray diffraction set-up for dynamic compression experiments in the diamond anvil cell. [PDF]

J Synchrotron Radiat, 2023
Husband RJ, Strohm C, Appel K, Ball OB, Briggs R, Buchen J, Cerantola V, Chariton S, Coleman AL, Cynn H, Dattelbaum D, Dwivedi A, Eggert JH, Ehm L, Evans WJ, Glazyrin K, Goncharov AF, Graafsma H, Howard A, Huston L, Hutchinson TM, Hwang H, Jacob S, Kaa J, Kim J, Kim M, Koemets E, Konôpková Z, Langenhorst F, Laurus T, Li X, Mainberger J, Marquardt H, McBride EE, McGuire C, McHardy JD, McMahon MI, McWilliams RS, Méndez ASJ, Mondal A, Morard G, O'Bannon EF, Otzen C, Pépin CM, Prakapenka VB, Prescher C, Preston TR, Redmer R, Roeper M, Sanchez-Valle C, Smith D, Smith RF, Sneed D, Speziale S, Spitzbart T, Stern S, Sturtevant BT, Sztuk-Dambietz J, Talkovski P, Velisavljevic N, Vennari C, Wu Z, Yoo CS, Zastrau U, Jenei Z, Liermann HP.   +65 more
europepmc   +1 more source

Reidite Formation From Zircon Subjected to 20, 40, and 60 GPa Shock Experiments

Journal of Raman Spectroscopy, Volume 57, Issue 8, Page 1392-1406, August 2026.
Structure disordering as a result of shock pressure: In zircon shocked from 20 to 60 GPa, the shock‐induced structural disorder increases with increasing shock pressure (gray area). Shock disorder of zircon is an integral part of its transformation to reidite: Reidite occurs after amorphous material.
Dmitry A. Zamyatin, Elizaveta Kovaleva
wiley   +1 more source