Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe

doi:10.1103/PhysRevLett.120.185701

Title: Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe

Authors:: Chen, Nian-Ke; Li, Xian-Bin; Bang, Junhyeok; Wang, Xue-Peng; Han, Dong; West, Damien; Zhang, Shangbai; Sun, Hong-Bo

Publication Date:: 2018-05-04

Sponsoring Org.:: USDOE

OSTI Identifier:: 1435993

Grant/Contract Number:: SC0002623

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Physical Review Letters

Additional Journal Information:: Journal Name: Physical Review Letters Journal Volume: 120 Journal Issue: 18; Journal ID: ISSN 0031-9007

Publisher:: American Physical Society

Country of Publication:: United States

Language:: English

Citation Formats


                    Chen, Nian-Ke, Li, Xian-Bin, Bang, Junhyeok, Wang, Xue-Peng, Han, Dong, West, Damien, Zhang, Shangbai, and Sun, Hong-Bo. Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe.  United States: N. p., 2018. 
        Web.  doi:10.1103/PhysRevLett.120.185701.

Copy to clipboard


                    Chen, Nian-Ke, Li, Xian-Bin, Bang, Junhyeok, Wang, Xue-Peng, Han, Dong, West, Damien, Zhang, Shangbai, & Sun, Hong-Bo. Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe.  United States.  doi:10.1103/PhysRevLett.120.185701.

Copy to clipboard


                    Chen, Nian-Ke, Li, Xian-Bin, Bang, Junhyeok, Wang, Xue-Peng, Han, Dong, West, Damien, Zhang, Shangbai, and Sun, Hong-Bo. Fri .  
        "Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe".  United States.  doi:10.1103/PhysRevLett.120.185701.

Copy to clipboard


                    
@article{osti_1435993,

  title        = {Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe},

  author       = {Chen, Nian-Ke and Li, Xian-Bin and Bang, Junhyeok and Wang, Xue-Peng and Han, Dong and West, Damien and Zhang, Shangbai and Sun, Hong-Bo},

  abstractNote = {},

  doi          = {10.1103/PhysRevLett.120.185701},

  journal      = {Physical Review Letters},

  number       = 18,

  volume       = 120,

  place        = {United States},

  year         = {2018},

  month        = {5}

}

Copy to clipboard

Journal Article:

Free Publicly Available Full Text

Accepted Manuscript (Publisher)

Publisher's Version of Record
DOI: 10.1103/PhysRevLett.120.185701

Other availability

Search WorldCat to find libraries that may hold this journal

Citation Metrics:

Cited by: 2 works

Citation information provided by
Web of Science

Save / Share:

Export Metadata

Save to My Library

Works referenced in this record:

Understanding the phase-change mechanism of rewritable optical media
journal, September 2004

Kolobov, Alexander V.; Fons, Paul; Frenkel, Anatoly I.
Nature Materials, Vol. 3, Issue 10
DOI: 10.1038/nmat1215

Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)]
journal, February 1997

Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
Physical Review Letters, Vol. 78, Issue 7
DOI: 10.1103/PhysRevLett.78.1396

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
DOI: 10.1016/0927-0256(96)00008-0

Phase-change materials for rewriteable data storage
journal, November 2007

Wuttig, Matthias; Yamada, Noboru
Nature Materials, Vol. 6, Issue 11
DOI: 10.1038/nmat2009

More Surprises in Theoretical Physics
journal, October 1992

Peierls, Rudolf; Barut, A. O.
American Journal of Physics, Vol. 60, Issue 10
DOI: 10.1119/1.17028

Theory for displacive excitation of coherent phonons
journal, January 1992

Zeiger, H. J.; Vidal, J.; Cheng, T. K.
Physical Review B, Vol. 45, Issue 2
DOI: 10.1103/PhysRevB.45.768

Diatomic Ferroelectrics
journal, October 1966

Pawley, G. S.; Cochran, W.; Cowley, R. A.
Physical Review Letters, Vol. 17, Issue 14
DOI: 10.1103/PhysRevLett.17.753

Ab initio evidence for nonthermal characteristics in ultrafast laser melting
journal, November 2016

Lian, Chao; Zhang, S. B.; Meng, Sheng
Physical Review B, Vol. 94, Issue 18
DOI: 10.1103/PhysRevB.94.184310

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
DOI: 10.1103/PhysRevB.54.11169

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
DOI: 10.1103/PhysRevB.59.1758

Electron counting model and its application to island structures on molecular-beam epitaxy grown GaAs(001) and ZnSe(001)
journal, November 1989

Pashley, M. D.
Physical Review B, Vol. 40, Issue 15
DOI: 10.1103/PhysRevB.40.10481

Excitation-Assisted Disordering of GeTe and Related Solids with Resonant Bonding
journal, May 2014

Kolobov, A. V.; Fons, P.; Tominaga, J.
The Journal of Physical Chemistry C, Vol. 118, Issue 19
DOI: 10.1021/jp412412j

Role of Electronic Excitation in the Amorphization of Ge-Sb-Te Alloys
journal, June 2011

Li, Xian-Bin; Liu, X. Q.; Liu, Xin
Physical Review Letters, Vol. 107, Issue 1
DOI: 10.1103/PhysRevLett.107.015501

Transient Structures and Possible Limits of Data Recording in Phase-Change Materials
journal, June 2015

Hu, Jianbo; Vanacore, Giovanni M.; Yang, Zhe
ACS Nano, Vol. 9, Issue 7
DOI: 10.1021/acsnano.5b01965

Ultrafast lasers—reliable tools for advanced materials processing
journal, April 2014

Sugioka, Koji; Cheng, Ya
Light: Science & Applications, Vol. 3, Issue 4
DOI: 10.1038/lsa.2014.30

Aqueous multiphoton lithography with multifunctional silk-centred bio-resists
journal, October 2015

Sun, Yun-Lu; Li, Qi; Sun, Si-Ming
Nature Communications, Vol. 6, Issue 1
DOI: 10.1038/ncomms9612

Microscopic origin of the fast crystallization ability of Ge–Sb–Te phase-change memory materials
journal, March 2008

Hegedüs, J.; Elliott, S. R.
Nature Materials, Vol. 7, Issue 5
DOI: 10.1038/nmat2157

Real-time, local basis-set implementation of time-dependent density functional theory for excited state dynamics simulations
journal, August 2008

Meng, Sheng; Kaxiras, Efthimios
The Journal of Chemical Physics, Vol. 129, Issue 5
DOI: 10.1063/1.2960628

Multivalency-Induced Band Gap Opening at MoS ₂ Edges
journal, April 2015

Lucking, Michael C.; Bang, Junhyeok; Terrones, Humberto
Chemistry of Materials, Vol. 27, Issue 9
DOI: 10.1021/acs.chemmater.5b00398

Optical Properties and Band Structure of Group IV-VI and Group V Materials
journal, March 1964

Cardona, Manuel; Greenaway, D. L.
Physical Review, Vol. 133, Issue 6A
DOI: 10.1103/PhysRev.133.A1685

Efficient and mechanically robust stretchable organic light-emitting devices by a laser-programmable buckling process
journal, May 2016

Yin, Da; Feng, Jing; Ma, Rui
Nature Communications, Vol. 7, Issue 1
DOI: 10.1038/ncomms11573

Initial Atomic Motion Immediately Following Femtosecond-Laser Excitation in Phase-Change Materials
journal, September 2016

Matsubara, E.; Okada, S.; Ichitsubo, T.
Physical Review Letters, Vol. 117, Issue 13
DOI: 10.1103/PhysRevLett.117.135501

Amorphous versus Crystalline GeTe Films. I. Growth and Structural Behavior
journal, September 1969

Chopra, K. L.; Bahl, S. K.
Journal of Applied Physics, Vol. 40, Issue 10
DOI: 10.1063/1.1657161

Efficient Formalism for Large-Scale Ab Initio Molecular Dynamics based on Time-Dependent Density Functional Theory
journal, August 2008

Alonso, J. L.; Andrade, X.; Echenique, P.
Physical Review Letters, Vol. 101, Issue 9
DOI: 10.1103/PhysRevLett.101.096403

Generation of coherent THz phonons in GeTe ferroelectrics
journal, May 2000

Hase, Muneaki; Mizoguchi, Kohji; Nakashima, Shin-ichi
Journal of Luminescence, Vol. 87-89
DOI: 10.1016/S0022-2313(99)00433-0

Ultrafast amorphization in Ge_10Sb_2Te_13 thin film induced by single femtosecond laser pulse
journal, January 2010

Konishi, Mitsutaka; Santo, Hisashi; Hongo, Yuki
Applied Optics, Vol. 49, Issue 18
DOI: 10.1364/AO.49.003470

The order-disorder transition in GeTe: Views from different length-scales
journal, December 2011

Matsunaga, T.; Fons, P.; Kolobov, A. V.
Applied Physics Letters, Vol. 99, Issue 23
DOI: 10.1063/1.3665067

Inducing and probing non-thermal transitions in semiconductors using femtosecond laser pulses
journal, December 2002

Sundaram, S. K.; Mazur, E.
Nature Materials, Vol. 1, Issue 4
DOI: 10.1038/nmat767

Finer features for functional microdevices
journal, August 2001

Kawata, Satoshi; Sun, Hong-Bo; Tanaka, Tomokazu
Nature, Vol. 412, Issue 6848, p. 697-698
DOI: 10.1038/35089130

Carrier-Multiplication-Induced Structural Change during Ultrafast Carrier Relaxation and Nonthermal Phase Transition in Semiconductors
journal, September 2016

Bang, Junhyeok; Sun, Y. Y.; Liu, X. -Q.
Physical Review Letters, Vol. 117, Issue 12
DOI: 10.1103/PhysRevLett.117.126402

Optical properties and energy gap of GeTe from reflectance studies
journal, September 1973

Lewis, J. E.
Physica Status Solidi (b), Vol. 59, Issue 1
DOI: 10.1002/pssb.2220590138

Phase transition in crystalline GeTe: Pitfalls of averaging effects
journal, October 2010

Fons, Paul; Kolobov, Alexander V.; Krbal, Milos
Physical Review B, Vol. 82, Issue 15
DOI: 10.1103/PhysRevB.82.155209

Efficient pseudopotentials for plane-wave calculations
journal, January 1991

Troullier, N.; Martins, José Luriaas
Physical Review B, Vol. 43, Issue 3
DOI: 10.1103/PhysRevB.43.1993

Similar Records in DOE PAGES and OSTI.GOV collections:

Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe

Journal Article Chen, Nian-Ke ; Li, Xian-Bin ; Bang, Junhyeok ; ... - Physical Review Letters

Not provided.
DOI: 10.1103/physrevlett.120.185701
Finite-temperature second-order many-body perturbation and Hartree–Fock theories for one-dimensional solids: An application to Peierls and charge-density-wave transitions in conjugated polymers

Journal Article He, Xiao ; State Key Laboratory of Precision Spectroscopy and Department of Physics, Institute of Theoretical and Computational Science, East China Normal University, Shanghai 200062 ; Ryu, Shinsei ; ... - Journal of Chemical Physics

Finite-temperature extensions of ab initio Gaussian-basis-set spin-restricted Hartree–Fock (HF) and second-order many-body perturbation (MP2) theories are implemented for infinitely extended, periodic, one-dimensional solids and applied to the Peierls and charge-density-wave (CDW) transitions in polyyne and all-trans polyacetylene. The HF theory predicts insulating CDW ground states for both systems in their equidistant structures at low temperatures. In the same structures, they turn metallic at high temperatures. Starting from the “dimerized” low-temperature equilibrium structures, the systems need even higher temperatures to undergo a Peierls transition, which is accompanied by geometric as well as electronic distortions from dimerized to non-dimerized forms. The conventionalmore »« less
DOI: 10.1063/1.4859257
Most theoretical approaches used in nuclear astrophysics to model the nucleosynthesis of heavy elements incorporate the so-called statistical model in order to describe the excitation and decay properties of atomic nuclei. One of the basic assumptions of this model is the validity of the Brink–Axel hypothesis and the related concept of so-called photon strength functions to describe γ-ray transition probabilities. We present a novel experimental approach that allows for the first time to experimentally determine the photon strength function simultaneously in two independent ways by a unique combination of quasi-monochromatic photon beams and a newly implemented γ–γ coincidence setup. This technique does not assume a priori the validity of the Brink–Axel hypothesis and sets a benchmark in terms of the detection sensitivity for measuring decay properties of photo-excited states below the neutron separation energy. The data for the spherical off-shell nucleus ¹²⁸Te were obtained for γ-ray beam-energy settings between 3 MeV and 9 MeV in steps of 130 keV for the lower beam energies and in steps of up to 280 keV for the highest beam settings. We present a quantitative analysis on the consistency of the derived photon strength function with the Brink–Axel hypothesis. The data clearly demonstrate a discrepancy of up to a factor of two between the photon strength functions extracted from the photoabsorption and photon emission process, respectively. In addition, we observe that the photon strength functions are not independent of the excitation energy, as usually assumed. Thus, we conclude, that the Brink–Axel hypothesis is not strictly fulfilled in the excitation-energy region below the neutron separation threshold (S _n = 8.78 MeV) for the studied case of ¹²⁸Te.

Journal Article Isaak, J. ; Savran, D. ; Löher, B. ; ... - Physics Letters B
Cited by 9
DOI: 10.1016/j.physletb.2018.11.038
Properties of solid solutions based on GeTe in the GeTe-ScTe and GeTe-ScTe-PbTe systems

Journal Article Abrikosov, N Kh ; Avilov, E S ; Karpinskii, O G ; ... - Inorg. Mater. (Engl. Transl.); (United States)

The authors have examined the effects of scandium replacing germanium on the structure, electrophysical parameters, and phase transitions in solid solutions based on germanium telluride in the GeTe-ScTe and GeTe-ScTe-PbTe systems. X-ray and dilatometric measurements on solid solutions based on GeTe in the GeTe-ScTe and GeTe-ScTe-PbTe systems show that ScTe dissolving in GeTe substantially reduces the rhombohedral distortion in the ..cap alpha.. phase and reduces the ..cap alpha.. ..-->.. ..beta.. transition temperature. Scandium monotelluride has a donor action in germanium telluride and reduces the hole concentration but increases the thermo-emf.
Direct Observation of Room-Temperature Polar Ordering in Colloidal GeTe Nanocrystals

Journal Article Polking, Mark J ; Zheng, Haimei ; Urban, Jeffrey J ; ... - Science

Ferroelectrics and other materials that exhibit spontaneous polar ordering have demonstrated immense promise for applications ranging from non-volatile memories to microelectromechanical systems. However, experimental evidence of polar ordering and effective synthetic strategies for accessing these materials are lacking for low-dimensional nanomaterials. Here, we demonstrate the synthesis of size-controlled nanocrystals of the polar material germanium telluride (GeTe) using colloidal chemistry and provide the first direct evidence of room-temperature polar ordering in nanocrystals less than 5 nm in size using aberration-corrected transmission electron microscopy. Synchrotron x-ray diffraction and Raman studies demonstrate a sizeable polar distortion and a reversible size-dependent polar phase transitionmore »« less
Full Text Available

Similar Records

Title: Directional Forces by Momentumless Excitation and Order-to-Order Transition in Peierls-Distorted Solids: The Case of GeTe

Citation Formats

Understanding the phase-change mechanism of rewritable optical media journal, September 2004

Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)] journal, February 1997

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set journal, July 1996

Phase-change materials for rewriteable data storage journal, November 2007

More Surprises in Theoretical Physics journal, October 1992

Theory for displacive excitation of coherent phonons journal, January 1992

Diatomic Ferroelectrics journal, October 1966

Ab initio evidence for nonthermal characteristics in ultrafast laser melting journal, November 2016

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

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

Electron counting model and its application to island structures on molecular-beam epitaxy grown GaAs(001) and ZnSe(001) journal, November 1989

Excitation-Assisted Disordering of GeTe and Related Solids with Resonant Bonding journal, May 2014

Role of Electronic Excitation in the Amorphization of Ge-Sb-Te Alloys journal, June 2011

Transient Structures and Possible Limits of Data Recording in Phase-Change Materials journal, June 2015

Ultrafast lasers—reliable tools for advanced materials processing journal, April 2014

Aqueous multiphoton lithography with multifunctional silk-centred bio-resists journal, October 2015

Microscopic origin of the fast crystallization ability of Ge–Sb–Te phase-change memory materials journal, March 2008

Real-time, local basis-set implementation of time-dependent density functional theory for excited state dynamics simulations journal, August 2008

Multivalency-Induced Band Gap Opening at MoS 2 Edges journal, April 2015

Optical Properties and Band Structure of Group IV-VI and Group V Materials journal, March 1964

Efficient and mechanically robust stretchable organic light-emitting devices by a laser-programmable buckling process journal, May 2016

Initial Atomic Motion Immediately Following Femtosecond-Laser Excitation in Phase-Change Materials journal, September 2016

Amorphous versus Crystalline GeTe Films. I. Growth and Structural Behavior journal, September 1969

Efficient Formalism for Large-Scale Ab Initio Molecular Dynamics based on Time-Dependent Density Functional Theory journal, August 2008

Generation of coherent THz phonons in GeTe ferroelectrics journal, May 2000

Ultrafast amorphization in Ge_10Sb_2Te_13 thin film induced by single femtosecond laser pulse journal, January 2010

The order-disorder transition in GeTe: Views from different length-scales journal, December 2011

Inducing and probing non-thermal transitions in semiconductors using femtosecond laser pulses journal, December 2002

Finer features for functional microdevices journal, August 2001

Carrier-Multiplication-Induced Structural Change during Ultrafast Carrier Relaxation and Nonthermal Phase Transition in Semiconductors journal, September 2016

Optical properties and energy gap of GeTe from reflectance studies journal, September 1973

Phase transition in crystalline GeTe: Pitfalls of averaging effects journal, October 2010

Efficient pseudopotentials for plane-wave calculations journal, January 1991

Understanding the phase-change mechanism of rewritable optical media
journal, September 2004

Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)]
journal, February 1997

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
journal, July 1996

Phase-change materials for rewriteable data storage
journal, November 2007

More Surprises in Theoretical Physics
journal, October 1992

Theory for displacive excitation of coherent phonons
journal, January 1992

Diatomic Ferroelectrics
journal, October 1966

Ab initio evidence for nonthermal characteristics in ultrafast laser melting
journal, November 2016

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

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

Electron counting model and its application to island structures on molecular-beam epitaxy grown GaAs(001) and ZnSe(001)
journal, November 1989

Excitation-Assisted Disordering of GeTe and Related Solids with Resonant Bonding
journal, May 2014

Role of Electronic Excitation in the Amorphization of Ge-Sb-Te Alloys
journal, June 2011

Transient Structures and Possible Limits of Data Recording in Phase-Change Materials
journal, June 2015

Ultrafast lasers—reliable tools for advanced materials processing
journal, April 2014

Aqueous multiphoton lithography with multifunctional silk-centred bio-resists
journal, October 2015

Microscopic origin of the fast crystallization ability of Ge–Sb–Te phase-change memory materials
journal, March 2008

Real-time, local basis-set implementation of time-dependent density functional theory for excited state dynamics simulations
journal, August 2008

Multivalency-Induced Band Gap Opening at MoS ₂ Edges
journal, April 2015

Optical Properties and Band Structure of Group IV-VI and Group V Materials
journal, March 1964

Efficient and mechanically robust stretchable organic light-emitting devices by a laser-programmable buckling process
journal, May 2016

Initial Atomic Motion Immediately Following Femtosecond-Laser Excitation in Phase-Change Materials
journal, September 2016

Amorphous versus Crystalline GeTe Films. I. Growth and Structural Behavior
journal, September 1969

Efficient Formalism for Large-Scale Ab Initio Molecular Dynamics based on Time-Dependent Density Functional Theory
journal, August 2008

Generation of coherent THz phonons in GeTe ferroelectrics
journal, May 2000

Ultrafast amorphization in Ge_10Sb_2Te_13 thin film induced by single femtosecond laser pulse
journal, January 2010

The order-disorder transition in GeTe: Views from different length-scales
journal, December 2011

Inducing and probing non-thermal transitions in semiconductors using femtosecond laser pulses
journal, December 2002

Finer features for functional microdevices
journal, August 2001

Carrier-Multiplication-Induced Structural Change during Ultrafast Carrier Relaxation and Nonthermal Phase Transition in Semiconductors
journal, September 2016

Optical properties and energy gap of GeTe from reflectance studies
journal, September 1973

Phase transition in crystalline GeTe: Pitfalls of averaging effects
journal, October 2010

Efficient pseudopotentials for plane-wave calculations
journal, January 1991