SCOPUS 정보 검색 플랫폼

Physical Review B - Condensed Matter and Materials Physics

Volumn 81, Issue 1, 2010, Pages

First-principles study of liquid and amorphous Sb2 Te3

(3) Caravati, S a Bernasconi, M b Parrinello, M a

a ETH ZURICH (Switzerland)

b UNIVERSITY OF MILANO BICOCCA (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 77954787326 PISSN: 10980121 EISSN: 1550235X Source Type: Journal
DOI: 10.1103/PhysRevB.81.014201 Document Type: Article

Times cited : (97)

References (39)

1
- 35748985544
- Phase-change materials for rewriteable data storage
- DOI 10.1038/nmat2009, PII NMAT2009
- M. Wuttig and N. Yamada, Nature Mater. 6, 824 (2007). 10.1038/nmat2009 (Pubitemid 350050578)
- (2007) Nature Materials , vol.6 , Issue.11 , pp. 824-832
- Wuttig, M.¹ Yamada, N.²

2
- 54249155606
- 10.1002/pssa.200723561
- A. L. Lacaita and D. J. Wouters, Phys. Status Solidi A 205, 2281 (2008). 10.1002/pssa.200723561
- (2008) Phys. Status Solidi A , vol.205 , pp. 2281
- Lacaita, A.L.¹ Wouters, D.J.²

3
- 1642327470
- 10.1109/TED.2003.823243
- A. Pirovano, A. L. Lacaita, A. Benvenuti, F. Pellizzer, and R. Bez, IEEE Trans. Electron Devices 51, 452 (2004). 10.1109/TED.2003.823243
- (2004) IEEE Trans. Electron Devices , vol.51 , pp. 452
- Pirovano, A.¹ Lacaita, A.L.² Benvenuti, A.³ Pellizzer, F.⁴ Bez, R.⁵

4
- 34848833814
- 3 films and their application to phase-change memory
- DOI 10.1063/1.2778737
- Y. Yin, H. Sone, and S. Hosaka, J. Appl. Phys. 102, 064503 (2007). 10.1063/1.2778737 (Pubitemid 47508985)
- (2007) Journal of Applied Physics , vol.102 , Issue.6 , pp. 064503
- Yin, Y.¹ Sone, H.² Hosaka, S.³

5
- 35548995391
- Coexistence of tetrahedral- and octahedral-like sites in amorphous phase change materials
- DOI 10.1063/1.2801626
- S. Caravati, M. Bernasconi, T. D. Kühne, M. Krack, and M. Parrinello, Appl. Phys. Lett. 91, 171906 (2007). 10.1063/1.2801626 (Pubitemid 350015222)
- (2007) Applied Physics Letters , vol.91 , Issue.17 , pp. 171906
- Caravati, S.¹ Bernasconi, M.² Kuhne, T.D.³ Krack, M.⁴ Parrinello, M.⁵

6
- 85154022225
- 10.1088/0953-8984/21/25/255501
- S. Caravati, M. Bernasconi, T. D. Kühne, M. Krack, and M. Parrinello, J. Phys.: Condens. Matter 21, 255501 (2009). 10.1088/0953-8984/21/ 25/255501
- (2009) J. Phys.: Condens. Matter , vol.21 , pp. 255501
- Caravati, S.¹ Bernasconi, M.² Kühne, T.D.³ Krack, M.⁴ Parrinello, M.⁵

7
- 5444235653
- 10.1038/nmat1215
- A. V. Kolobov, P. Fons, A. I. Frenkel, A. L. Ankudinov, J. Tominaga, and T. Uruga, Nature Mater. 3, 703 (2004). 10.1038/nmat1215
- (2004) Nature Mater. , vol.3 , pp. 703
- Kolobov, A.V.¹ Fons, P.² Frenkel, A.I.³ Ankudinov, A.L.⁴ Tominaga, J.⁵ Uruga, T.⁶

8
- 36849049207
- 10.1103/PhysRevB.76.235201
- J. Akola and R. O. Jones, Phys. Rev. B 76, 235201 (2007). 10.1103/PhysRevB.76.235201
- (2007) Phys. Rev. B , vol.76 , pp. 235201
- Akola, J.¹ Jones, R.O.²

9
- 58149337249
- 10.1088/0953-8984/20/46/465103
- J. Akola and R. O. Jones, J. Phys.: Condens. Matter 20, 465103 (2008). 10.1088/0953-8984/20/46/465103
- (2008) J. Phys.: Condens. Matter , vol.20 , pp. 465103
- Akola, J.¹ Jones, R.O.²

10
- 42549141873
- Microscopic origin of the fast crystallization ability of Ge-Sb-Te phase-change memorymaterials
- DOI 10.1038/nmat2157, PII NMAT2157
- J. Hegedus and S. R. Elliott, Nature Mater. 7, 399 (2008). 10.1038/nmat2157 (Pubitemid 351596372)
- (2008) Nature Materials , vol.7 , Issue.5 , pp. 399-405
- Hegedus, J.¹ Elliott, S.R.²

11
- 33846891132
- Efficient and accurate car-parrinello-like approach to born-oppenheimer molecular dynamics
- DOI 10.1103/PhysRevLett.98.066401
- T. D. Kühne, M. Krack, F. R. Mohamed, and M. Parrinello, Phys. Rev. Lett. 98, 066401 (2007). 10.1103/PhysRevLett.98.066401 (Pubitemid 46220444)
- (2007) Physical Review Letters , vol.98 , Issue.6 , pp. 066401
- Kuhne, T.D.¹ Krack, M.² Mohamed, F.R.³ Parrinello, M.⁴

12
- 33947147025
- in edited by J. Grotendorst, NIC Vol. 25 (NIC-Directors, Jülich
- M. Krack and M. Parrinello, in High Performance Computing in Chemistry, edited by, J. Grotendorst,, NIC Vol. 25 (NIC-Directors, Jülich, 2004), pp. 29-51
- (2004) High Performance Computing in Chemistry , pp. 29-51
- Krack, M.¹ Parrinello, M.²

13
- 77954772056
- http://cp2k.berlios.de

14
- 15344345714
- Quickstep: Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach
- DOI 10.1016/j.cpc.2004.12.014, PII S0010465505000615
- J. VandeVondele, M. Krack, F. Mohamed, M. Parrinello, T. Chassaing, and J. Hutter, Comput. Phys. Commun. 167, 103 (2005). 10.1016/j.cpc.2004.12.014 (Pubitemid 40391124)
- (2005) Computer Physics Communications , vol.167 , Issue.2 , pp. 103-128
- Vandevondele, J.¹ Krack, M.² Mohamed, F.³ Parrinello, M.⁴ Chassaing, T.⁵ Hutter, J.⁶

15
- 4243943295
- 10.1103/PhysRevLett.77.3865
- J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996). 10.1103/PhysRevLett.77.3865
- (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
- Perdew, J.P.¹ Burke, K.² Ernzerhof, M.³

16
- 0000160164
- 10.1103/PhysRevB.54.1703;
- S. Goedecker, M. Teter, and J. Hutter, Phys. Rev. B 54, 1703 (1996) 10.1103/PhysRevB.54.1703
- (1996) Phys. Rev. B , vol.54 , pp. 1703
- Goedecker, S.¹ Teter, M.² Hutter, J.³

17
- 25144446255
- Pseudopotentials for H to Kr optimized for gradient-corrected exchange-correlation functionals
- DOI 10.1007/s00214-005-0655-y
- M. Krack, Theor. Chem. Acc. 114, 145 (2005). 10.1007/s00214-005-0655-y (Pubitemid 41355884)
- (2005) Theoretical Chemistry Accounts , vol.114 , Issue.1-3 , pp. 145-152
- Krack, M.¹

18
- 77954765568
- Extension of the basis set to QZV2P does not introduce sizable change in the pair-correlation functions of GST (Ref.)
- Extension of the basis set to QZV2P does not introduce sizable change in the pair-correlation functions of GST (Ref.).

19
- 0242710587
- 10.1143/JPSJ.72.2546
- K. J. Singh, R. Satoh, and Y. Tsuchiya, J. Phys. Soc. Jpn. 72, 2546 (2003). 10.1143/JPSJ.72.2546
- (2003) J. Phys. Soc. Jpn. , vol.72 , pp. 2546
- Singh, K.J.¹ Satoh, R.² Tsuchiya, Y.³

20
- 0035068050
- A comparison of various commonly used correlation functions for describing total scattering
- DOI 10.1107/S0021889800019993
- D. A. Keen, J. Appl. Crystallogr. 34, 172 (2001). 10.1107/ S0021889800019993 (Pubitemid 32293573)
- (2001) Journal of Applied Crystallography , vol.34 , Issue.2 , pp. 172-177
- Keen, D.A.¹

21
- 0020142056
- 10.1002/pssa.2210710231
- T. Satow, O. Uemura, and Y. Sagara, Phys. Status Solidi A 71, 555 (1982). 10.1002/pssa.2210710231
- (1982) Phys. Status Solidi A , vol.71 , pp. 555
- Satow, T.¹ Uemura, O.² Sagara, Y.³

22
- 57349170077
- 10.1002/adma.200700016
- C. Steimer, V. Coulet, W. Welnic, H. Dieker, R. Detemple, C. Bichara, B. Beuneu, J.-P. Gaspard, and M. Wuttig, Adv. Mater. 20, 4535 (2008). 10.1002/adma.200700016
- (2008) Adv. Mater. , vol.20 , pp. 4535
- Steimer, C.¹ Coulet, V.² Welnic, W.³ Dieker, H.⁴ Detemple, R.⁵ Bichara, C.⁶ Beuneu, B.⁷ Gaspard, J.-P.⁸ Wuttig, M.⁹

23
- 77954786149
- (unpublished)
- R. Mazzarello, S. Caravati, S. Angioletti-Uberti, M. Bernasconi, and M. Parrinello (unpublished).
- Mazzarello, R.¹ Caravati, S.² Angioletti-Uberti, S.³ Bernasconi, M.⁴ Parrinello, M.⁵

24
- 0001176443
- 10.1107/S0567740874004729
- T. L. Anderson and H. B. Krause, Acta Crystallogr., Sect. B 30, 1307 (1974). 10.1107/S0567740874004729
- (1974) Acta Crystallogr., Sect. B , vol.30 , pp. 1307
- Anderson, T.L.¹ Krause, H.B.²

25
- 65549132506
- 10.1088/0953-8984/21/9/095410
- G. C. Sosso, S. Caravati, and M. Bernasconi, J. Phys.: Condens. Matter 21, 095410 (2009). 10.1088/0953-8984/21/9/095410
- (2009) J. Phys.: Condens. Matter , vol.21 , pp. 095410
- Sosso, G.C.¹ Caravati, S.² Bernasconi, M.³

26
- 0001033548
- 10.1103/PhysRevB.44.4925
- D. S. Franzblau, Phys. Rev. B 44, 4925 (1991). 10.1103/PhysRevB.44.4925
- (1991) Phys. Rev. B , vol.44 , pp. 4925
- Franzblau, D.S.¹

27
- 0348112259
- 10.1088/0022-3719/14/20/009
- H. Rauh, R. Geick, H. Kohler, N. Nucker, and N. Lehner, J. Phys. C 14, 2705 (1981). 10.1088/0022-3719/14/20/009
- (1981) J. Phys. C , vol.14 , pp. 2705
- Rauh, H.¹ Geick, R.² Kohler, H.³ Nucker, N.⁴ Lehner, N.⁵

28
- 9144221025
- Oxford University Press, Oxford
- L.-M. Peng, S. L. Dudarev, and M. J. Whelan, High Energy Electron Diffraction and Microscopy (Oxford University Press, Oxford, 2004).
- (2004) High Energy Electron Diffraction and Microscopy
- Peng, L.-M.¹ Dudarev, S.L.² Whelan, M.J.³

29
- 10844241458
- Morphology of voids in molecular systems. A Voronoi-Delaunay analysis of a simulated DMPC membrane
- DOI 10.1021/jp040386q
- M. G. Alinchenko, A. V. Anikeenko, N. N. Medvedev, V. P. Voloshin, M. Mezei, and P. Jedlovszky, J. Phys. Chem. B 108, 19056 (2004). 10.1021/jp040386q (Pubitemid 40003270)
- (2004) Journal of Physical Chemistry B , vol.108 , Issue.49 , pp. 19056-19067
- Alinchenko, M.G.¹ Anikeenko, A.V.² Medvedev, N.N.³ Voloshin, V.P.⁴ Mezei, M.⁵ Jedlovszky, P.⁶

30
- 33749183416
- An algorithm for three-dimensional Voronoi S-network
- DOI 10.1002/jcc.20484
- N. N. Medvedev, V. P. Voloshin, V. A. Luchnikov, and M. L. Gavrilova, J. Comput. Chem. 27, 1676 (2006). 10.1002/jcc.20484 (Pubitemid 44476664)
- (2006) Journal of Computational Chemistry , vol.27 , Issue.14 , pp. 1676-1692
- Medvedev, N.N.¹ Voloshin, V.P.² Luchnikov, V.A.³ Gavrilova, M.L.⁴

31
- 77954800969
- http://www.kinetics.nsc.ru/sms/?Software:VNP

32
- 70349898125
- 10.1063/1.3236786
- S. Raoux, B. Munoz, H.-Yu. Cheng, and J. L. Jordan-Sweet, Appl. Phys. Lett. 95, 143118 (2009). 10.1063/1.3236786
- (2009) Appl. Phys. Lett. , vol.95 , pp. 143118
- Raoux, S.¹ Munoz, B.² Cheng, H.-Yu.³ Jordan-Sweet, J.L.⁴

33
- 67650954408
- 10.1146/annurev-matsci-082908-145405
- S. Raoux, Annu. Rev. Mater. Res. 39, 25 (2009). 10.1146/annurev-matsci- 082908-145405
- (2009) Annu. Rev. Mater. Res. , vol.39 , pp. 25
- Raoux, S.¹

34
- 77954770491
- See supplementary material at, for the phonon density of states and Debye-Waller factor at the LDA level of theory and Mulliken and Löwdin charges of a -Sb 2 Te 3
- See supplementary material at http://link.aps.org/supplemental/10.1103/ PhysRevB.81.014201 for the phonon density of states and Debye-Waller factor at the LDA level of theory and Mulliken and Löwdin charges of a -Sb 2 Te 3.

35
- 0037799714
- 10.1063/1.1564060
- J. Heyd, G. E. Scuseria, and M. Ernzerhof, J. Chem. Phys. 118, 8207 (2003). 10.1063/1.1564060
- (2003) J. Chem. Phys. , vol.118 , pp. 8207
- Heyd, J.¹ Scuseria, G.E.² Ernzerhof, M.³

36
- 47549101214
- 10.1063/1.2959818
- J.-W. Park, Appl. Phys. Lett. 93, 021914 (2008). 10.1063/1.2959818
- (2008) Appl. Phys. Lett. , vol.93 , pp. 021914
- Park, J.-W.¹

37
- 33745753520
- A fast and robust algorithm for Bader decomposition of charge density
- DOI 10.1016/j.commatsci.2005.04.010, PII S0927025605001849
- G. Henkelman, A. Arnaldsson, and H. Jonsson, Comput. Mater. Sci. 36, 354 (2006). 10.1016/j.commatsci.2005.04.010 (Pubitemid 44382438)
- (2006) Computational Materials Science , vol.36 , Issue.3 , pp. 354-360
- Henkelman, G.¹ Arnaldsson, A.² Jonsson, H.³

38
- 35949030565
- 10.1103/PhysRevLett.37.1504
- K. Kastner, D. Adler, and H. Fritzshe, Phys. Rev. Lett. 37, 1504 (1976). 10.1103/PhysRevLett.37.1504
- (1976) Phys. Rev. Lett. , vol.37 , pp. 1504
- Kastner, K.¹ Adler, D.² Fritzshe, H.³

39
- 49749109556
- 10.1063/1.2967742
- Z. Sun, J. Zhou, A. Blomqvist, B. Johansson, and R. Ahuja, Appl. Phys. Lett. 93, 061913 (2008). 10.1063/1.2967742
- (2008) Appl. Phys. Lett. , vol.93 , pp. 061913
- Sun, Z.¹ Zhou, J.² Blomqvist, A.³ Johansson, B.⁴ Ahuja, R.⁵

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.