DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Pressure-induced multiple phase transformations of the BaBi 3 superconductor

Abstract

Measurements of temperature-dependent resistance and magnetization under hydrostatic pressures up to 2.13 GPa are reported for single-crystalline, superconducting BaBi3. A temperature-pressure phase diagram is determined and the results suggest three different superconducting phases α, β, and γ in the studied pressure range. We further show that the occurrence of the three superconducting phases is intuitively linked to phase transitions at higher temperature, which are likely first order and structural in nature. With the α phase being the ambient-pressure tetragonal structure (P4/mmm), our first-principles calculations suggest the β phase has a cubic structure (Pm–3m) and the γ phase has a distorted tetragonal structure where the Bi atoms are moved out of the face-centered position. Finally, an analysis of the evolution of the superconducting upper critical field with pressure further confirms these transitions in the superconducting state and suggests a possible change of band structure or a Lifshitz transition near 1.54 GPa in γ phase. As a result, given the large atomic numbers of both Ba and Bi, our results establish BaBi3 as a good candidate for the study of the interplay of structure with superconductivity in the presence of strong spin-orbit coupling.

Authors:
 [1];  [2];  [1];  [1];  [1];  [1];  [1];  [1];  [1]
  1. Ames Lab. and Iowa State Univ., Ames, IA (United States)
  2. Iowa State Univ., Ames, IA (United States); Univ. Federal do ABC (UFABC), Santo Andre, SP (Brazil)
Publication Date:
Research Org.:
Ames Lab., Ames, IA (United States)
Sponsoring Org.:
USDOE
OSTI Identifier:
1494941
Alternate Identifier(s):
OSTI ID: 1485736
Report Number(s):
IS-J-9830
Journal ID: ISSN 2469-9950; PRBMDO
Grant/Contract Number:  
AC02-07CH11358; GBMF4411; 2011/19924-2
Resource Type:
Accepted Manuscript
Journal Name:
Physical Review B
Additional Journal Information:
Journal Volume: 98; Journal Issue: 21; Journal ID: ISSN 2469-9950
Publisher:
American Physical Society (APS)
Country of Publication:
United States
Language:
English
Subject:
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY

Citation Formats

Xiang, Li, Ribeiro, Raquel A., Kaluarachchi, Udhara S., Gati, Elena, Nguyen, Manh Cuong, Wang, Cai -Zhuang, Ho, Kai -Ming, Bud'ko, Sergey L., and Canfield, Paul C. Pressure-induced multiple phase transformations of the BaBi3 superconductor. United States: N. p., 2018. Web. doi:10.1103/PhysRevB.98.214509.
Xiang, Li, Ribeiro, Raquel A., Kaluarachchi, Udhara S., Gati, Elena, Nguyen, Manh Cuong, Wang, Cai -Zhuang, Ho, Kai -Ming, Bud'ko, Sergey L., & Canfield, Paul C. Pressure-induced multiple phase transformations of the BaBi3 superconductor. United States. https://doi.org/10.1103/PhysRevB.98.214509
Xiang, Li, Ribeiro, Raquel A., Kaluarachchi, Udhara S., Gati, Elena, Nguyen, Manh Cuong, Wang, Cai -Zhuang, Ho, Kai -Ming, Bud'ko, Sergey L., and Canfield, Paul C. Thu . "Pressure-induced multiple phase transformations of the BaBi3 superconductor". United States. https://doi.org/10.1103/PhysRevB.98.214509. https://www.osti.gov/servlets/purl/1494941.
@article{osti_1494941,
title = {Pressure-induced multiple phase transformations of the BaBi3 superconductor},
author = {Xiang, Li and Ribeiro, Raquel A. and Kaluarachchi, Udhara S. and Gati, Elena and Nguyen, Manh Cuong and Wang, Cai -Zhuang and Ho, Kai -Ming and Bud'ko, Sergey L. and Canfield, Paul C.},
abstractNote = {Measurements of temperature-dependent resistance and magnetization under hydrostatic pressures up to 2.13 GPa are reported for single-crystalline, superconducting BaBi3. A temperature-pressure phase diagram is determined and the results suggest three different superconducting phases α, β, and γ in the studied pressure range. We further show that the occurrence of the three superconducting phases is intuitively linked to phase transitions at higher temperature, which are likely first order and structural in nature. With the α phase being the ambient-pressure tetragonal structure (P4/mmm), our first-principles calculations suggest the β phase has a cubic structure (Pm–3m) and the γ phase has a distorted tetragonal structure where the Bi atoms are moved out of the face-centered position. Finally, an analysis of the evolution of the superconducting upper critical field with pressure further confirms these transitions in the superconducting state and suggests a possible change of band structure or a Lifshitz transition near 1.54 GPa in γ phase. As a result, given the large atomic numbers of both Ba and Bi, our results establish BaBi3 as a good candidate for the study of the interplay of structure with superconductivity in the presence of strong spin-orbit coupling.},
doi = {10.1103/PhysRevB.98.214509},
journal = {Physical Review B},
number = 21,
volume = 98,
place = {United States},
year = {Thu Dec 13 00:00:00 EST 2018},
month = {Thu Dec 13 00:00:00 EST 2018}
}

Journal Article:

Citation Metrics:
Cited by: 5 works
Citation information provided by
Web of Science

Save / Share:

Works referenced in this record:

Generalized Gradient Approximation Made Simple
journal, October 1996

  • Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
  • Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
  • DOI: 10.1103/PhysRevLett.77.3865

Pressure-temperature phase diagrams of CaK ( Fe 1 x Ni x ) 4 As 4 superconductors
journal, May 2018


Topological insulators and superconductors
journal, October 2011


High-pressure magnetic susceptibility experiments on the heavy lanthanides Gd, Tb, Dy, Ho, Er, and Tm
journal, May 2005


A diamond anvil cell for the investigation of superconductivity under pressures of up to 50 GPa: Pb as a low temperature manometer
journal, September 1988


Use of frit-disc crucibles for routine and exploratory solution growth of single crystalline samples
journal, December 2015


Projector augmented-wave method
journal, December 1994


Large enhancement of superconducting transition temperature of SrBi3 induced by Na substitution for Sr
journal, May 2015

  • Iyo, Akira; Yanagi, Yousuke; Kinjo, Tatsuya
  • Scientific Reports, Vol. 5, Issue 1
  • DOI: 10.1038/srep10089

Special points for Brillouin-zone integrations
journal, June 1976

  • Monkhorst, Hendrik J.; Pack, James D.
  • Physical Review B, Vol. 13, Issue 12, p. 5188-5192
  • DOI: 10.1103/PhysRevB.13.5188

Pressure-induced structural phase transitions in zirconia under high pressure
journal, June 1993


Anisotropic physical properties and pressure dependent magnetic ordering of CrAuTe 4
journal, November 2016


Colloquium: Topological insulators
journal, November 2010


Experimental Realization of a Three-Dimensional Topological Insulator, Bi2Te3
journal, June 2009


Pressure-induced Magnetic Transition in a Single Crystal of YbCo 2 Zn 20
journal, May 2008

  • Saiga, Yuta; Matsubayashi, Kazuyuki; Fujiwara, Tetsuya
  • Journal of the Physical Society of Japan, Vol. 77, Issue 5
  • DOI: 10.1143/JPSJ.77.053710

Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
journal, October 1996


Bismuth-based candidates for topological insulators: Chemistry beyond Bi 2 Te 3
journal, February 2013

  • Isaeva, Anna; Rasche, Bertold; Ruck, Michael
  • physica status solidi (RRL) - Rapid Research Letters, Vol. 7, Issue 1-2
  • DOI: 10.1002/pssr.201206405

From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999


Observation of a large-gap topological-insulator class with a single Dirac cone on the surface
journal, May 2009

  • Xia, Y.; Qian, D.; Hsieh, D.
  • Nature Physics, Vol. 5, Issue 6, p. 398-402
  • DOI: 10.1038/nphys1274

Nonmonotonic pressure evolution of the upper critical field in superconducting FeSe
journal, February 2016

  • Kaluarachchi, Udhara S.; Taufour, Valentin; Böhmer, Anna E.
  • Physical Review B, Vol. 93, Issue 6
  • DOI: 10.1103/PhysRevB.93.064503

Solidification of High-Pressure Medium Daphne 7373
journal, June 2007

  • Yokogawa, Keiichi; Murata, Keizo; Yoshino, Harukazu
  • Japanese Journal of Applied Physics, Vol. 46, Issue 6A
  • DOI: 10.1143/JJAP.46.3636

Spin-orbit coupling enhanced superconductivity in Bi-rich compounds ABi3 (A = Sr and Ba)
journal, February 2016

  • Shao, D. F.; Luo, X.; Lu, W. J.
  • Scientific Reports, Vol. 6, Issue 1
  • DOI: 10.1038/srep21484

Complete pressure-dependent phase diagrams for SrFe 2 As 2 and BaFe 2 As 2
journal, June 2009


A Search for New Superconducting Compounds
journal, September 1952


Superconductivity in LaBi 3 with AuCu 3 -type structure
journal, February 2016


Tricritical wings and modulated magnetic phases in LaCrGe3 under pressure
journal, September 2017

  • Kaluarachchi, Udhara S.; Bud’ko, Sergey L.; Canfield, Paul C.
  • Nature Communications, Vol. 8, Issue 1
  • DOI: 10.1038/s41467-017-00699-x

Growth of single crystals from metallic fluxes
journal, June 1992


Pressure-induced variation of Kondo behavior on the heavy fermion compounds YbT 2 Zn 20 (T = Co, Rh, Ir)
journal, January 2010

  • Matsubayashi, Kazuyuki; Saiga, Yuta; Matsumoto, Takehiko
  • Journal of Physics: Conference Series, Vol. 200, Issue 1
  • DOI: 10.1088/1742-6596/200/1/012112

Pressure as a parameter in the study of dilute magnetic alloys
journal, October 1979


Orbital upper critical field and its anisotropy of clean one- and two-band superconductors
journal, October 2012


High pressure studies on Fe-pnictide superconductors
journal, May 2009


Superconductivity emerging from a suppressed large magnetoresistant state in tungsten ditelluride
journal, July 2015

  • Kang, Defen; Zhou, Yazhou; Yi, Wei
  • Nature Communications, Vol. 6, Issue 1
  • DOI: 10.1038/ncomms8804

Superconductivity in Cu x Bi 2 Se 3 and its Implications for Pairing in the Undoped Topological Insulator
journal, February 2010


Solidification and loss of hydrostaticity in liquid media used for pressure measurements
journal, December 2015

  • Torikachvili, M. S.; Kim, S. K.; Colombier, E.
  • Review of Scientific Instruments, Vol. 86, Issue 12
  • DOI: 10.1063/1.4937478

Dome of magnetic order inside the nematic phase of sulfur-substituted FeSe under pressure
journal, July 2017


High-pressure Raman studies of polycrystalline BaTiO 3
journal, December 1998


Upper critical field of K Fe 2 As 2 under pressure: A test for the change in the superconducting gap structure
journal, June 2014


Hydrostatic pressure effect on the superconducting properties of BaBi 3 and SrBi 3 single crystals
journal, December 2016


Fermi Surface Properties Based on the Relativistic Effect in SrBi 3 with AuCu 3 -Type Cubic Structure
journal, December 2015

  • Kakihana, Masashi; Akamine, Hiromu; Yara, Tomoyuki
  • Journal of the Physical Society of Japan, Vol. 84, Issue 12
  • DOI: 10.7566/JPSJ.84.124702

Low‐temperature pressure variations in a self‐clamping pressure cell
journal, February 1984

  • Thompson, J. D.
  • Review of Scientific Instruments, Vol. 55, Issue 2
  • DOI: 10.1063/1.1137730

Search for pressure-induced quantum criticality in YbFe 2 Zn 20
journal, July 2013


Superconducting properties of BaBi 3
journal, August 2014

  • Haldolaarachchige, Neel; Kushwaha, S. K.; Gibson, Quinn
  • Superconductor Science and Technology, Vol. 27, Issue 10
  • DOI: 10.1088/0953-2048/27/10/105001

Self-Consistent Equations Including Exchange and Correlation Effects
journal, November 1965


Pressure-induced phase transition in LaAlO 3
journal, April 2002


Pressure-induced phase transition of Bi 2 Te 3 to a bcc structure
journal, March 2011