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Related papers: ScPd2Al3 New Polymorphic Phase in Al-Pd-Sc System

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The structural properties of the CaFe2As2 have been investigated by x-ray and neutron powder diffraction techniques as a function of temperature. Unambiguous experimental evidence is shown for coexistence of tetragonal and orthorhombic…

Superconductivity · Physics 2013-11-27 S. K. Mishra , R. Mittal , P. S. R. Krishna , P. U. Sastry , S. L. Chaplot , P. D. Babu , S. Matsuishi , H. Hosono

High-pressure powder x-ray diffraction experiments have revealed that sodium and gold react at room temperature and form new Na-Au intermetallic compounds under high pressure. We have identified four intermetallic phases up to 60 GPa. The…

Materials Science · Physics 2015-05-28 K. Takemura , H. Fujihisa

We report a computer-simulation study of the equilibrium phase diagram of a three-dimensional system of particles with a repulsive step potential. Using free-energy calculations, we have determined the equilibrium phase diagram of this…

Soft Condensed Matter · Physics 2009-11-13 Yu. D. Fomin , Daan Frenkel , N. V. Gribova , V. N. Ryzhov , S. M. Stishov

Plate-like single crystals of SrFe2As2 as large as 3x3x0.5 mm3 have been grown out of Sn flux. The SrFe2As2 single crystals show a structural phase transition from a high temperature tetragonal phase to a low temperature orthorhombic phase…

Silver-based chalcohalide anti-perovskites (CAP), Ag$_{3}$BC (B = S, Se; C = Cl, Br, I), represent an emerging family of energy materials with intriguing optoelectronic, vibrational and ionic transport properties. However, the structural…

We report temperature dependent ac susceptibility ($\chi$) measurements on a high quality single crystal of Tb$_2$PdSi$_3$, crystallizing in a AlB$_2$-derived hexagonal structure. This compound is found to exhibit features attributable to…

Strongly Correlated Electrons · Physics 2007-05-23 P. L. Paulose , E. V. Sampathkumaran , H. Bitterlich , G. Behr , W. Loser

The newly discovered superconductors A2Cr3As3 (A = K, Rb, Cs), with a quasi-one-dimensional crystal structure have attracted considerable interest. The crystal structure consists of double-walled tubes of [Cr3As3]^(2-) that extend along the…

Single crystals of Sc5Rh6Sn18 were grown from Sn-flux. The crystal structure (SG: I41/acd, a = 13.5529(2) {\AA}, c = 27.0976(7) {\AA}) was studied by high-resolution X-ray diffraction on powder and single crystal material as well as by TEM.…

Investigations of clathrate structures have gained a new impetus with the recent discovery of room-temperature superconductivity in metal hydrides. Here we report the finding, through density functional theory calculations, of a clathrate…

Materials Science · Physics 2021-08-02 Jorge Laranjeira , Leonel Marques , Manuel Melle-Franco , Karol Strutynski , Manuel Barroso

Exploring the chemistry of materials at high pressures has lead to the discovery of previously unknown exotic compounds. Here, we systematically search for all thermodynamically stable Sr-C compounds under pressure (up to 100 GPa) using the…

Materials Science · Physics 2025-06-30 Nikita Rybin , Evgeny Moerman , Pranab Gain , Artem R. Oganov , Alexander Shapeev

Satterthwaite and Toepke (1970 Phys. Rev. Lett. 25 741) predicted high-temperature superconductivity in hydrogen-rich metallic alloys, based on an idea that these compounds should exhibit high Debye frequency of the proton lattice, which…

Superconductivity · Physics 2021-09-21 E. F. Talantsev

Results of in situ high pressure x-ray powder diffraction on the mixed valence compound Cs2Au(I)Au(III)I6 (CsAuI3) are reported, for pressures up to 21 GPa in a diamond anvil cell under hydrostatic conditions. We find a reversible…

Strongly Correlated Electrons · Physics 2013-02-07 Shibing Wang , Shigeto Hirai , Maxwell C. Shapiro , Scott C. Riggs , Theodore H. Geballe , Wendy L. Mao , Ian R. Fisher

We report X-ray structural studies of the metal-insulator phase transition in bismuth ferrite, BiFeO3, both as a function of temperature and of pressure (931 oC at atmospheric pressure and ca. 45 GPa at ambient temperature). Based on the…

Materials Science · Physics 2009-02-05 S. A. T. Redfern , J. N. Walsh , S. M. Clark , G. Catalan , J. F. Scott

Group theoretical aspects of the three temperature-dependent and temperature-reversible experimentally observed phase transitions in the KNbO3 crystal (cubic-tetragonal, tetragonal-orthorhombic, orthorhombic-rhombohedral) in the framework…

Materials Science · Physics 2024-11-05 R. A. Evarestov , Yu. E. Kitaev , S. S. Novikov

SrRh2As2 exhibits structural phase transitions reminiscent to those of BaFe2As2, but crystallizes with three polymorphs derived from the tetragonal ThCr2Si2-type structure. The structure of \alpha-SrRh2As2 is monoclinic with a = 421.2(1)…

Superconductivity · Physics 2012-02-02 V. Zinth , V. Petricek , M. Dusek , D. Johrendt

Recently a new monoclinic phase in the PbZr(1-x)TixO3 ceramic system has been reported by Noheda et al. for the composition x= 0.48. In the present work, samples with Ti contents of x= 0.47 and 0.50, which are both tetragonal below their…

Materials Science · Physics 2007-05-23 B. Noheda , J. A. Gonzalo , A. Caballero , C. Moure , D. E. Cox , G. Shirane

Multiple structure and symmetry types and their transformations are discovered in quasi-two-dimensional (quasi-2D) Cr2Ge2Te6 crystal in surprisingly very narrow temperature range of 2 K and magnetic field range of 0.07 T using a homebuilt…

Materials Science · Physics 2018-03-22 Tengfei Guo , Zongwei Ma , Gaoting Lin , Xuan Luo , Yubin Hou , Yuping Sun , Zhigao Sheng , Qingyou Lu

Old and novel layered structures are attracting increasing attention for their physical, electronic, and frictional properties. SiS$_2$, isoelectronic to SiO$_2$, CO$_2$ and CS$_2$, is a material whose phases known experimentally up to 6…

Chemical Physics · Physics 2016-09-13 Dušan Plašienka , Roman Martoňák , Erio Tosatti

This paper presents a new highly stable periodic approximant to the Al-based F-type icosahedral quasicrystals, i-Al-Pd-TM (TM=transition metals). The structure of this intermetallic Al-Pd-Cr-Fe compound is determined ab initio using…

Materials Science · Physics 2013-04-23 Nobuhisa Fujita , Hikari Takano , Akiji Yamamoto , An-Pang Tsai

We report on the synthesis and physical properties of the new ternary intermetallic Ce$_2$Rh$_2$Ga. Its formation and dimorphism have been investigated by powder and single crystal X-ray diffractometry, as well as by differential thermal…

Strongly Correlated Electrons · Physics 2020-05-12 Sergey Nesterenko , Anna Tursina , Mathieu Pasturel , Sindisiwe Xhakaza , André Strydom