Pressure-induced half-collapsed-tetragonal phase in
Abstract
Here, we report the temperature-pressure phase diagram of CaKFe4As4 established using high-pressure electrical resistivity, magnetization, and high-energy x-ray diffraction measurements up to 6 GPa. With increasing pressure, both resistivity and magnetization data show that the bulk superconducting transition of CaKFe4As4 is suppressed and then disappears at p ≳ 4 GPa. High-pressure x-ray data clearly indicate a phase transition to a collapsed tetragonal phase in CaKFe4As4 under pressure that coincides with the abrupt loss of bulk superconductivity near 4 GPa. The x-ray data, combined with resistivity data, indicate that the collapsed tetragonal transition line is essentially independent of pressure, occurring at 4.0(5) GPa for temperatures below 150 K. Density functional theory calculations also find a sudden transition to a collapsed tetragonal state near 4 GPa, as As-As bonding develops across the Ca layer. Bonding across the K layer only occurs for p ≥ 12 GPa. These findings demonstrate a different type of collapsed tetragonal phase in CaKFe4As4 as compared to CaFe2As2: a half-collapsed tetragonal phase.
- Authors:
-
- Ames Lab. and Iowa State Univ., Ames, IA (United States)
- Ames Lab. and Iowa State Univ., Ames, IA (United States); Univ. of California, Davis, CA (United States)
- Goethe Univ. Frankfurt am Main, Frankfurt am Main (Germany)
- Ames Lab. and Iowa State Univ., Ames, IA (United States); Princeton Univ., Princeton, NJ (United States)
- Publication Date:
- Research Org.:
- Ames Lab., Ames, IA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1406563
- Alternate Identifier(s):
- OSTI ID: 1395910
- Report Number(s):
- IS-J-9469
Journal ID: ISSN 2469-9950; PRBMDO; TRN: US1703266
- Grant/Contract Number:
- AC02-07CH11358; AC02-06CH11357; SFB/TR49
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Physical Review B
- Additional Journal Information:
- Journal Volume: 96; Journal Issue: 14; 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
Kaluarachchi, Udhara S., Taufour, Valentin, Sapkota, Aashish, Borisov, Vladislav, Kong, Tai, Meier, William R., Kothapalli, Karunakar, Ueland, Benjamin G., Kreyssig, Andreas, Valenti, Roser, McQueeney, Robert J., Goldman, Alan I., Bud'ko, Sergey L., and Canfield, Paul C. Pressure-induced half-collapsed-tetragonal phase in CaKFe4As4. United States: N. p., 2017.
Web. doi:10.1103/PhysRevB.96.140501.
Kaluarachchi, Udhara S., Taufour, Valentin, Sapkota, Aashish, Borisov, Vladislav, Kong, Tai, Meier, William R., Kothapalli, Karunakar, Ueland, Benjamin G., Kreyssig, Andreas, Valenti, Roser, McQueeney, Robert J., Goldman, Alan I., Bud'ko, Sergey L., & Canfield, Paul C. Pressure-induced half-collapsed-tetragonal phase in CaKFe4As4. United States. https://doi.org/10.1103/PhysRevB.96.140501
Kaluarachchi, Udhara S., Taufour, Valentin, Sapkota, Aashish, Borisov, Vladislav, Kong, Tai, Meier, William R., Kothapalli, Karunakar, Ueland, Benjamin G., Kreyssig, Andreas, Valenti, Roser, McQueeney, Robert J., Goldman, Alan I., Bud'ko, Sergey L., and Canfield, Paul C. Mon .
"Pressure-induced half-collapsed-tetragonal phase in CaKFe4As4". United States. https://doi.org/10.1103/PhysRevB.96.140501. https://www.osti.gov/servlets/purl/1406563.
@article{osti_1406563,
title = {Pressure-induced half-collapsed-tetragonal phase in CaKFe4As4},
author = {Kaluarachchi, Udhara S. and Taufour, Valentin and Sapkota, Aashish and Borisov, Vladislav and Kong, Tai and Meier, William R. and Kothapalli, Karunakar and Ueland, Benjamin G. and Kreyssig, Andreas and Valenti, Roser and McQueeney, Robert J. and Goldman, Alan I. and Bud'ko, Sergey L. and Canfield, Paul C.},
abstractNote = {Here, we report the temperature-pressure phase diagram of CaKFe4As4 established using high-pressure electrical resistivity, magnetization, and high-energy x-ray diffraction measurements up to 6 GPa. With increasing pressure, both resistivity and magnetization data show that the bulk superconducting transition of CaKFe4As4 is suppressed and then disappears at p ≳ 4 GPa. High-pressure x-ray data clearly indicate a phase transition to a collapsed tetragonal phase in CaKFe4As4 under pressure that coincides with the abrupt loss of bulk superconductivity near 4 GPa. The x-ray data, combined with resistivity data, indicate that the collapsed tetragonal transition line is essentially independent of pressure, occurring at 4.0(5) GPa for temperatures below 150 K. Density functional theory calculations also find a sudden transition to a collapsed tetragonal state near 4 GPa, as As-As bonding develops across the Ca layer. Bonding across the K layer only occurs for p ≥ 12 GPa. These findings demonstrate a different type of collapsed tetragonal phase in CaKFe4As4 as compared to CaFe2As2: a half-collapsed tetragonal phase.},
doi = {10.1103/PhysRevB.96.140501},
journal = {Physical Review B},
number = 14,
volume = 96,
place = {United States},
year = {Mon Oct 02 00:00:00 EDT 2017},
month = {Mon Oct 02 00:00:00 EDT 2017}
}
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Works referenced in this record:
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
- Bireckoven, B.; Wittig, J.
- Journal of Physics E: Scientific Instruments, Vol. 21, Issue 9
Similarities between structural distortions under pressure and chemical doping in superconducting BaFe2As2
journal, May 2009
- Kimber, Simon A. J.; Kreyssig, Andreas; Zhang, Yu-Zhong
- Nature Materials, Vol. 8, Issue 6
Tuning the ground state of BaFe 2 As 2 : Phase diagrams and empirical trends
journal, August 2011
- Ni, Ni; Bud’ko, Sergey L.
- MRS Bulletin, Vol. 36, Issue 8
Projector augmented-wave method
journal, December 1994
- Blöchl, P. E.
- Physical Review B, Vol. 50, Issue 24, p. 17953-17979
Sudden reversal in the pressure dependence of Tc in the iron-based superconductor KFe2As2
journal, May 2013
- Tafti, F. F.; Juneau-Fecteau, A.; Delage, M-È.
- Nature Physics, Vol. 9, Issue 6
Superconductivity at 35.5 K in K-Doped CaFe2As2
journal, March 2013
- Wang, D. M.; Shangguan, X. C.; He, J. B.
- Journal of Superconductivity and Novel Magnetism, Vol. 26, Issue 6
Online remote control systems for static and dynamic compression and decompression using diamond anvil cells
journal, July 2015
- Sinogeikin, Stanislav V.; Smith, Jesse S.; Rod, Eric
- Review of Scientific Instruments, Vol. 86, Issue 7
From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999
- Kresse, G.; Joubert, D.
- Physical Review B, Vol. 59, Issue 3, p. 1758-1775
Iron-Based Layered Superconductor La[O 1- x F x ]FeAs ( x = 0.05−0.12) with T c = 26 K
journal, March 2008
- Kamihara, Yoichi; Watanabe, Takumi; Hirano, Masahiro
- Journal of the American Chemical Society, Vol. 130, Issue 11
Conventional empirical law reverses in the phase transitions of 122-type iron-based superconductors
journal, November 2014
- Yu, Zhenhai; Wang, Lin; Wang, Luhong
- Scientific Reports, Vol. 4, Issue 1
Phase transition and superconductivity of SrFe 2 As 2 under high pressure
journal, March 2011
- Uhoya, Walter O.; Montgomery, Jeffrey M.; Tsoi, Georgiy M.
- Journal of Physics: Condensed Matter, Vol. 23, Issue 12
Complete pressure-dependent phase diagrams for and
journal, June 2009
- Colombier, E.; Bud’ko, S. L.; Ni, N.
- Physical Review B, Vol. 79, Issue 22
Synthesis and properties of CaFe 2 As 2 single crystals
journal, July 2008
- Ronning, F.; Klimczuk, T.; Bauer, E. D.
- Journal of Physics: Condensed Matter, Vol. 20, Issue 32
Absence of superconductivity in the collapsed tetragonal phase of under hydrostatic pressure
journal, July 2016
- Wang, Bosen; Matsubayashi, Kazuyuki; Cheng, Jinguang
- Physical Review B, Vol. 94, Issue 2
In-plane uniaxial stress effects on the structural and electronic properties of BaFe As and CaFe As
journal, May 2013
- Tomić, Milan; Jeschke, Harald O.; Fernandes, Rafael M.
- Physical Review B, Vol. 87, Issue 17
Structural phase transitions in EuFe 2 As 2 superconductor at low temperatures and high pressures
journal, August 2011
- Uhoya, Walter O.; Tsoi, Georgiy M.; Vohra, Yogesh K.
- Journal of Physics: Condensed Matter, Vol. 23, Issue 36
Origin of the superconducting state in the collapsed tetragonal phase of
journal, April 2015
- Guterding, Daniel; Backes, Steffen; Jeschke, Harald O.
- Physical Review B, Vol. 91, Issue 14
Calibration of the pressure dependence of the R 1 ruby fluorescence line to 195 kbar
journal, June 1975
- Piermarini, G. J.; Block, S.; Barnett, J. D.
- Journal of Applied Physics, Vol. 46, Issue 6
Ab initiomolecular dynamics for liquid metals
journal, January 1993
- Kresse, G.; Hafner, J.
- Physical Review B, Vol. 47, Issue 1, p. 558-561
Pressure effects on two superconducting iron-based families
journal, September 2011
- Sefat, Athena S.
- Reports on Progress in Physics, Vol. 74, Issue 12
Upper critical field of under pressure: A test for the change in the superconducting gap structure
journal, June 2014
- Taufour, Valentin; Foroozani, Neda; Tanatar, Makariy A.
- Physical Review B, Vol. 89, Issue 22
Dramatic changes in the electronic structure upon transition to the collapsed tetragonal phase in CaFe As
journal, January 2014
- Dhaka, R. S.; Jiang, Rui; Ran, S.
- Physical Review B, Vol. 89, Issue 2
Coexistence of the spin-density wave and superconductivity in Ba 1−x K x Fe 2 As 2
journal, January 2009
- Chen, H.; Ren, Y.; Qiu, Y.
- EPL (Europhysics Letters), Vol. 85, Issue 1
Two distinct superconducting states in under high pressure
journal, April 2014
- Terashima, Taichi; Kihou, Kunihiro; Sugii, Kaori
- Physical Review B, Vol. 89, Issue 13
Superconductivity at 43 K in an iron-based layered compound LaO1-xFxFeAs
journal, April 2008
- Takahashi, Hiroki; Igawa, Kazumi; Arii, Kazunobu
- Nature, Vol. 453, Issue 7193
First-order structural phase transition in
journal, July 2008
- Ni, N.; Nandi, S.; Kreyssig, A.
- Physical Review B, Vol. 78, Issue 1
Anisotropic thermodynamic and transport properties of single-crystalline
journal, August 2016
- Meier, W. R.; Kong, T.; Kaluarachchi, U. S.
- Physical Review B, Vol. 94, Issue 6
Pressure transmitting medium Daphne 7474 solidifying at 3.7 GPa at room temperature
journal, August 2008
- Murata, Keizo; Yokogawa, Keiichi; Yoshino, Harukazu
- Review of Scientific Instruments, Vol. 79, Issue 8
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
journal, July 1996
- Kresse, G.; Furthmüller, J.
- Computational Materials Science, Vol. 6, Issue 1, p. 15-50
Pressure Induced Superconductivity in
journal, July 2008
- Torikachvili, Milton S.; Bud’ko, Sergey L.; Ni, Ni
- Physical Review Letters, Vol. 101, Issue 5
Superconductivity up to 29 K in SrFe 2 As 2 and BaFe 2 As 2 at high pressures
journal, December 2008
- Alireza, Patricia L.; Ko, Y. T. Chris; Gillett, Jack
- Journal of Physics: Condensed Matter, Vol. 21, Issue 1
Pressure and temperature dependence of electrical resistivity of Pb and Sn from 1-300K and 0-10 GPa-use as continuous resistive pressure monitor accurate over wide temperature range; superconductivity under pressure in Pb, Sn and In
journal, March 1981
- Eiling, A.; Schilling, J. S.
- Journal of Physics F: Metal Physics, Vol. 11, Issue 3
Effect of pressure on the structural phase transition and superconductivity in ( and 0.45) and single crystals
journal, September 2008
- Torikachvili, M. S.; Bud’ko, S. L.; Ni, N.
- Physical Review B, Vol. 78, Issue 10
Collapsed tetragonal phase and superconductivity of under high pressure
journal, October 2010
- Uhoya, Walter; Stemshorn, Andrew; Tsoi, Georgiy
- Physical Review B, Vol. 82, Issue 14
Hydrostatic-pressure tuning of magnetic, nonmagnetic, and superconducting states in annealed Ca(Fe Co ) As
journal, December 2012
- Gati, E.; Köhler, S.; Guterding, D.
- Physical Review B, Vol. 86, Issue 22
New-Structure-Type Fe-Based Superconductors: Ca A Fe 4 As 4 ( A = K, Rb, Cs) and Sr A Fe 4 As 4 ( A = Rb, Cs)
journal, March 2016
- Iyo, Akira; Kawashima, Kenji; Kinjo, Tatsuya
- Journal of the American Chemical Society, Vol. 138, Issue 10
Pressure-induced volume-collapsed tetragonal phase of as seen via neutron scattering
journal, November 2008
- Kreyssig, A.; Green, M. A.; Lee, Y.
- Physical Review B, Vol. 78, Issue 18
Developments on Susceptibility and Magnetization Measurements under High Hydrostatic Pressure
journal, January 2007
- Lebre Alireza, Patricia; Barakat, Samira; Cumberlidge, Anne-Marie
- Journal of the Physical Society of Japan, Vol. 76, Issue Suppl.A
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
journal, October 1996
- Kresse, G.; Furthmüller, J.
- Physical Review B, Vol. 54, Issue 16, p. 11169-11186
High-temperature superconductivity stabilized by electron-hole interband coupling in collapsed tetragonal phase of under high pressure
journal, February 2015
- Nakajima, Yasuyuki; Wang, Renxiong; Metz, Tristin
- Physical Review B, Vol. 91, Issue 6
Simple adaptation of the Bridgman high pressure technique for use with liquid media
journal, September 2007
- Colombier, E.; Braithwaite, D.
- Review of Scientific Instruments, Vol. 78, Issue 9
Superconductivity and phase diagram in iron-based arsenic-oxides ReFeAsO 1−δ (Re = rare-earth metal) without fluorine doping
journal, June 2008
- Ren, Zhi-An; Che, Guang-Can; Dong, Xiao-Li
- EPL (Europhysics Letters), Vol. 83, Issue 1
Hydrostatic limits in liquids and solids to 100 kbar
journal, December 1973
- Piermarini, G. J.; Block, S.; Barnett, J. D.
- Journal of Applied Physics, Vol. 44, Issue 12
Superconducting Fe-Based Compounds with and Cs with Transition Temperatures up to 37 K
journal, September 2008
- Sasmal, Kalyan; Lv, Bing; Lorenz, Bernd
- Physical Review Letters, Vol. 101, Issue 10
FeAs-Based Superconductivity: A Case Study of the Effects of Transition Metal Doping on BaFe 2 As 2
journal, August 2010
- Canfield, Paul C.; Bud'ko, Sergey L.
- Annual Review of Condensed Matter Physics, Vol. 1, Issue 1
Absence of superconductivity in single-phase under hydrostatic pressure
journal, January 2009
- Yu, W.; Aczel, A. A.; Williams, T. J.
- Physical Review B, Vol. 79, Issue 2
Superconductivity and Crystal Structures of (Ba 1− x K x )Fe 2 As 2 ( x =0-1)
journal, September 2008
- Rotter, Marianne; Pangerl, Michael; Tegel, Marcus
- Angewandte Chemie International Edition, Vol. 47, Issue 41
Optimization of the crystal growth of the superconductor from solution in the system
journal, June 2017
- Meier, W. R.; Kong, T.; Bud'ko, S. L.
- Physical Review Materials, Vol. 1, Issue 1
Control of magnetic, nonmagnetic, and superconducting states in annealed Ca(Fe Co ) As
journal, June 2012
- Ran, S.; Bud'ko, S. L.; Straszheim, W. E.
- Physical Review B, Vol. 85, Issue 22
Uniaxial versus hydrostatic pressure-induced phase transitions in CaFe As and BaFe As
journal, March 2012
- Tomić, Milan; Valentí, Roser; Jeschke, Harald O.
- Physical Review B, Vol. 85, Issue 9
Anomalous compressibility effects and superconductivity of EuFe 2 As 2 under high pressures
journal, June 2010
- Uhoya, Walter; Tsoi, Georgiy; Vohra, Yogesh K.
- Journal of Physics: Condensed Matter, Vol. 22, Issue 29
Reducing Dzyaloshinskii-Moriya interaction and field-free spin-orbit torque switching in synthetic antiferromagnets
journal, May 2021
- Chen, Ruyi; Cui, Qirui; Liao, Liyang
- Nature Communications, Vol. 12, Issue 1
High-resolution X-ray luminescence extension imaging
journal, February 2021
- Ou, Xiangyu; Qin, Xian; Huang, Bolong
- Nature, Vol. 590, Issue 7846
Electronic structure of AlFeN films exhibiting crystallographic orientation change from c- to a-axis with Fe concentrations and annealing effect
journal, February 2020
- Tatemizo, Nobuyuki; Imada, Saki; Okahara, Kizuna
- Scientific Reports, Vol. 10, Issue 1
Superconductivity and Crystal Structures of (Ba1-xKx)Fe2As2 (x = 0 - 1)
text, January 2008
- Rotter, Marianne; Pangerl, Michael; Tegel, Marcus
- arXiv
FeAs-based superconductivity: a case study of the effects of transition metal doping on BaFe2As2
text, January 2010
- Canfield, Paul C.; Bud'ko, Sergey L.
- arXiv
Dramatic Changes in the Electronic Structure Upon Transition to the Collapsed Tetragonal Phase in CaFe2As2
text, January 2014
- Dhaka, R. S.; Jiang, Rui; Ran, S.
- arXiv
Works referencing / citing this record:
Hedgehog spin-vortex crystal stabilized in a hole-doped iron-based superconductor
journal, February 2018
- Meier, William R.; Ding, Qing-Ping; Kreyssig, Andreas
- npj Quantum Materials, Vol. 3, Issue 1
Ultrahigh elastically compressible and strain-engineerable intermetallic compounds under uniaxial mechanical loading
journal, June 2019
- Song, Gyuho; Borisov, Vladislav; Meier, William R.
- APL Materials, Vol. 7, Issue 6
Effect of pressure on the self-hole-doped superconductor RbGd 2 Fe 4 As 4 O 2
journal, December 2018
- Sun, J. P.; Wang, Z-C; Liu, Z. Y.
- Journal of Physics: Condensed Matter, Vol. 31, Issue 4
Flux pinning and the vortex phase diagram in optimized CaKFe 4 As 4 single crystals fabricated by a one-step method
journal, February 2020
- Wang, Chunlei; He, Tian; Han, Qianqian
- Superconductor Science and Technology, Vol. 33, Issue 4
Trends in pressure-induced layer-selective half-collapsed tetragonal phases in the iron-based superconductor family
journal, August 2018
- Borisov, Vladislav; Canfield, Paul C.; Valentí, Roser
- Physical Review B, Vol. 98, Issue 6
Hedgehog spin-vortex crystal stabilized in a hole-doped iron-based superconductor
text, January 2017
- Meier, W. R.; Ding, Q. -P.; Kreyssig, A.
- arXiv
Ultrahigh Elastically Compressible and Strain-Engineerable Intermetallic Compounds Under Uniaxial Mechanical Loading
preprint, January 2019
- Song, Gyuho; Borisov, Vladislav; Meier, William R.
- arXiv