-
1
-
-
34447130908
-
Thermodynamics: Highs and lows in the density of water
-
DOI 10.1038/nnano.2007.201, PII NNANO2007201
-
C. A. Angell, Nat. Nanotechnol. 2, 396 (2007). 10.1038/nnano.2007.201 (Pubitemid 47035625)
-
(2007)
Nature Nanotechnology
, vol.2
, Issue.7
, pp. 396-398
-
-
Angell, A.1
-
2
-
-
70349326166
-
-
10.1073/pnas.0904743106
-
C. Huang, K. T. Wikfeldt, T. Tokushima, D. Nordlund, Y. Harada, U. Bergmann, M. Niebuhr, T. M. Weiss, Y. Horikawa, M. Leetmaa, M. P. Ljungberg, O. Takahashi, A. Lenz, L. Ojame, A. P. Lyubartsev, S. Shin, L. G. M. Pettersson, and A. Nilsson, Proc. Natl. Acad. Sci. U.S.A. 106, 15214 (2009). 10.1073/pnas.0904743106
-
(2009)
Proc. Natl. Acad. Sci. U.S.A.
, vol.106
, pp. 15214
-
-
Huang, C.1
Wikfeldt, K.T.2
Tokushima, T.3
Nordlund, D.4
Harada, Y.5
Bergmann, U.6
Niebuhr, M.7
Weiss, T.M.8
Horikawa, Y.9
Leetmaa, M.10
Ljungberg, M.P.11
Takahashi, O.12
Lenz, A.13
Ojame, L.14
Lyubartsev, A.P.15
Shin, S.16
Pettersson, L.G.M.17
Nilsson, A.18
-
3
-
-
0000256814
-
-
10.1038/360324a0
-
P. H. Poole, F. Sciortino, U. Essmann, and H. E. Stanley, Nature (London) 360 (6402), 324 (1992). 10.1038/360324a0
-
(1992)
Nature (London)
, vol.360
, Issue.6402
, pp. 324
-
-
Poole, P.H.1
Sciortino, F.2
Essmann, U.3
Stanley, H.E.4
-
5
-
-
0032569809
-
The relationship between liquid, supercooled and glassy water
-
DOI 10.1038/24540
-
O. Mishima and H. E. Stanley, Nature (London) 396 (6709), 329 (1998). 10.1038/24540 (Pubitemid 28557386)
-
(1998)
Nature
, vol.396
, Issue.6709
, pp. 329-335
-
-
Mishima, O.1
Stanley, H.E.2
-
6
-
-
0001101089
-
-
10.1103/PhysRevE.53.6144
-
S. Sastry, P. G. Debenedetti, F. Sciortino, and H. E. Stanley, Phys. Rev. E 53 (6), 6144 (1996). 10.1103/PhysRevE.53.6144
-
(1996)
Phys. Rev. e
, vol.53
, Issue.6
, pp. 6144
-
-
Sastry, S.1
Debenedetti, P.G.2
Sciortino, F.3
Stanley, H.E.4
-
8
-
-
38849174857
-
Insights into phases of liquid water from study of its unusual glass-forming properties
-
DOI 10.1126/science.1131939
-
C. A. Angell, Science 319, 582 (2008). 10.1126/science.1131939 (Pubitemid 351197054)
-
(2008)
Science
, vol.319
, Issue.5863
, pp. 582-587
-
-
Angell, C.A.1
-
10
-
-
33845554274
-
-
10.1021/j100395a030
-
R. J. Speedy, J. Phys. Chem. 86, 982 (1982). 10.1021/j100395a030
-
(1982)
J. Phys. Chem.
, vol.86
, pp. 982
-
-
Speedy, R.J.1
-
12
-
-
76549109227
-
-
10.1073/pnas.0912756107
-
K. Stokely, M. G. Mazza, H. E. Stanley, and G. Franzese, Proc. Natl. Acad. Sci. U.S.A. 107, 1301 (2010). 10.1073/pnas.0912756107
-
(2010)
Proc. Natl. Acad. Sci. U.S.A.
, vol.107
, pp. 1301
-
-
Stokely, K.1
Mazza, M.G.2
Stanley, H.E.3
Franzese, G.4
-
13
-
-
0032510536
-
Decompression-induced melting of ice IV and the liquid-liquid transition in water
-
DOI 10.1038/32386
-
O. Mishima and H. E. Stanley, Nature (London) 392 (6672), 164 (1998). 10.1038/32386 (Pubitemid 28162785)
-
(1998)
Nature
, vol.392
, Issue.6672
, pp. 164-166
-
-
Mishima, O.1
Stanley, H.E.2
-
14
-
-
77958103084
-
-
10.1063/1.3487999
-
O. Mishima, J. Chem. Phys. 133, 144503 (2010). 10.1063/1.3487999
-
(2010)
J. Chem. Phys.
, vol.133
, pp. 144503
-
-
Mishima, O.1
-
15
-
-
33750686578
-
Scaled equation of state for supercooled water near the liquid-liquid critical point
-
DOI 10.1103/PhysRevLett.97.195702
-
D. A. Fuentevilla and M. A. Anisimov, Phys. Rev. Lett. 97, 195702 (2006). 10.1103/PhysRevLett.97.195702 (Pubitemid 44707955)
-
(2006)
Physical Review Letters
, vol.97
, Issue.19
, pp. 195702
-
-
Fuentevilla, D.A.1
Anisimov, M.A.2
-
16
-
-
78751576183
-
-
10.1063/1.3495974
-
C. Huang, T. M. Weiss, D. Nordlund, K. T. Wikfeldt, L. G. M. Pettersson, and A. Nilsson, J. Chem. Phys. 133, 134504 (2010). 10.1063/1.3495974
-
(2010)
J. Chem. Phys.
, vol.133
, pp. 134504
-
-
Huang, C.1
Weiss, T.M.2
Nordlund, D.3
Wikfeldt, K.T.4
Pettersson, L.G.M.5
Nilsson, A.6
-
18
-
-
77950378531
-
-
10.1073/pnas.0913504107
-
C. Huang, K. T. Wikfeldt, T. Tokushima, D. Nordlund, Y. Harada, U. Bergmann, M. Niebuhr, T. M. Weiss, Y. Horikawa, M. Leetmaa, M. P. Ljungberg, O. Takahashi, A. Lenz, L. Ojame, A. Lyubartsev, S. Shin, L. G. M. Pettersson, and A. Nilsson, Proc. Natl. Acad. Sci. U.S.A. 107, E45 (2010). 10.1073/pnas. 0913504107
-
(2010)
Proc. Natl. Acad. Sci. U.S.A.
, vol.107
, pp. 45
-
-
Huang, C.1
Wikfeldt, K.T.2
Tokushima, T.3
Nordlund, D.4
Harada, Y.5
Bergmann, U.6
Niebuhr, M.7
Weiss, T.M.8
Horikawa, Y.9
Leetmaa, M.10
Ljungberg, M.P.11
Takahashi, O.12
Lenz, A.13
Ojame, L.14
Lyubartsev, A.15
Shin, S.16
Pettersson, L.G.M.17
Nilsson, A.18
-
19
-
-
48949116116
-
-
10.1016/j.cplett.2008.04.077
-
T. Tokushima, Y. Harada, O. Takahashi, Y. Senba, H. Ohashi, L. G. M. Pettersson, A. Nilsson, and S. Shin, Chem. Phys. Lett. 460, 387 (2008). 10.1016/j.cplett.2008.04.077
-
(2008)
Chem. Phys. Lett.
, vol.460
, pp. 387
-
-
Tokushima, T.1
Harada, Y.2
Takahashi, O.3
Senba, Y.4
Ohashi, H.5
Pettersson, L.G.M.6
Nilsson, A.7
Shin, S.8
-
20
-
-
77950521422
-
-
10.1016/j.elspec.2010.02.008
-
T. Tokushima, Y. Harada, Y. Horikawa, O. Takahashi, Y. Senba, H. Ohashi, L. G. M. Pettersson, A. Nilsson, and S. Shin, J. Electron Spectrosc. Relat. Phenom. 177, 192 (2010). 10.1016/j.elspec.2010.02.008
-
(2010)
J. Electron Spectrosc. Relat. Phenom.
, vol.177
, pp. 192
-
-
Tokushima, T.1
Harada, Y.2
Horikawa, Y.3
Takahashi, O.4
Senba, Y.5
Ohashi, H.6
Pettersson, L.G.M.7
Nilsson, A.8
Shin, S.9
-
21
-
-
0037017586
-
Spectroscopic probing of local hydrogen-bonding structures in liquid water
-
DOI 10.1088/0953-8984/14/8/106, PII S0953898402327784
-
S. Myneni, Y. Luo, L.-. Nslund, M. Cavalleri, L. Ojame, H. Ogasawara, A. Pelmenschikov, P. Wernet, P. Vterlein, C. Heske, Z. Hussain, L. G. M. Pettersson, and A. Nilsson, J. Phys.: Condens. Matter 14, L213 (2002). 10.1088/0953-8984/14/8/106 (Pubitemid 34221041)
-
(2002)
Journal of Physics Condensed Matter
, vol.14
, Issue.8
-
-
Myneni, S.1
Luo, Y.2
Naslund, L.A.3
Cavalleri, M.4
Ojamae, L.5
Ogasawara, H.6
Pelmenschikov, A.7
Wernet, Ph.8
Vaterlein, P.9
Heske, C.10
Hussain, Z.11
Pettersson, L.G.M.12
Nilsson, A.13
-
22
-
-
2342558053
-
The Structure of the First Coordination Shell in Liquid Water
-
DOI 10.1126/science.1096205
-
P. Wernet, D. Nordlund, U. Bergmann, M. Cavalleri, M. Odelius, H. Ogasawara, L. Nslund, T. K. Hirsch, L. Ojame, P. Glatzel, L. G. M. Pettersson, and A. Nilsson, Science 304 (5673), 995 (2004). 10.1126/science.1096205 (Pubitemid 38638094)
-
(2004)
Science
, vol.304
, Issue.5673
, pp. 995-999
-
-
Wernet, Ph.1
Nordlund, D.2
Bergmann, U.3
Cavalleri, M.4
Odelius, N.5
Ogasawara, H.6
Naslund, L.A.7
Hirsch, T.K.8
Ojamae, L.9
Glatzel, P.10
Pettersson, L.G.M.11
Nilsson, A.12
-
23
-
-
77950517767
-
-
10.1016/j.elspec.2010.02.005
-
A. Nilsson, D. Nordlund, I. Waluyo, N. Huang, H. Ogasawara, S. Kaya, U. Bergmann, L.-. Nslund, H. strm, P. Wernet, K. J. Andersson, T. Schiros, and L. G. M. Pettersson, J. Electron Spectrosc. Relat. Phenom. 177, 99 (2010). 10.1016/j.elspec.2010.02.005
-
(2010)
J. Electron Spectrosc. Relat. Phenom.
, vol.177
, pp. 99
-
-
Nilsson, A.1
Nordlund, D.2
Waluyo, I.3
Huang, N.4
Ogasawara, H.5
Kaya, S.6
Bergmann, U.7
Nslund, L.8
Strm, H.9
Wernet, P.10
Andersson, K.J.11
Schiros, T.12
Pettersson, L.G.M.13
-
24
-
-
67650333026
-
-
10.1103/PhysRevB.79.144204
-
M. Odelius, Phys. Rev. B 79, 144204 (2009). 10.1103/PhysRevB.79.144204
-
(2009)
Phys. Rev. B
, vol.79
, pp. 144204
-
-
Odelius, M.1
-
25
-
-
67651064998
-
-
10.1021/jp903096k
-
M. Odelius, J. Phys. Chem. A 113, 8176 (2009). 10.1021/jp903096k
-
(2009)
J. Phys. Chem. A
, vol.113
, pp. 8176
-
-
Odelius, M.1
-
26
-
-
77954047502
-
-
10.1080/00268971003762134
-
G. N. I. Clark, C. D. Cappa, J. D. Smith, R. J. Saykally, and T. Head-Gordon, Mol. Phys. 108, 1415 (2010). 10.1080/00268971003762134
-
(2010)
Mol. Phys.
, vol.108
, pp. 1415
-
-
Clark, G.N.I.1
Cappa, C.D.2
Smith, J.D.3
Saykally, R.J.4
Head-Gordon, T.5
-
27
-
-
77954718685
-
-
10.1103/PhysRevB.80.233404
-
D. Nordlund, H. Ogasawara, K. J. Andersson, M. Tatarkhanov, M. Salmern, L. G. M. Pettersson, and A. Nilsson, Phys. Rev. B 80, 233404 (2009). 10.1103/PhysRevB.80.233404
-
(2009)
Phys. Rev. B
, vol.80
, pp. 233404
-
-
Nordlund, D.1
Ogasawara, H.2
Andersson, K.J.3
Tatarkhanov, M.4
Salmern, M.5
Pettersson, L.G.M.6
Nilsson, A.7
-
30
-
-
34247515172
-
The Widom line of supercooled water
-
DOI 10.1088/0953-8984/19/20/205126, PII S0953898407416514
-
G. Franzese and H. E. Stanley, J. Phys.: Condens. Matter 19, 205126 (2007). 10.1088/0953-8984/19/20/205126 (Pubitemid 46653758)
-
(2007)
Journal of Physics Condensed Matter
, vol.19
, Issue.20
, pp. 205126
-
-
Franzese, G.1
Stanley, H.E.2
-
31
-
-
24444475043
-
-
10.1103/PhysRevE.55.727
-
F. Sciortino, P. H. Poole, U. Essmann, and H. E. Stanley, Phys. Rev. E 55, 727 (1997). 10.1103/PhysRevE.55.727
-
(1997)
Phys. Rev. e
, vol.55
, pp. 727
-
-
Sciortino, F.1
Poole, P.H.2
Essmann, U.3
Stanley, H.E.4
-
32
-
-
77955947969
-
-
10.1088/0953-8984/22/28/284101
-
H. E. Stanley, S. V. Buldyrev, G. Franzese, P. Kumar, F. Mallamace, M. G. Mazza, K. Stokely, and L. Xu, J. Phys.: Condens. Matter 22, 284101 (2010). 10.1088/0953-8984/22/28/284101
-
(2010)
J. Phys.: Condens. Matter
, vol.22
, pp. 284101
-
-
Stanley, H.E.1
Buldyrev, S.V.2
Franzese, G.3
Kumar, P.4
Mallamace, F.5
Mazza, M.G.6
Stokely, K.7
Xu, L.8
-
33
-
-
33750187301
-
How does tetrahedral structure grow in liquid silicon upon supercooling?
-
DOI 10.1103/PhysRevLett.97.165502
-
T. Morishita, Phys. Rev. Lett. 97, 165502 (2006). 10.1103/PhysRevLett.97. 165502 (Pubitemid 44601540)
-
(2006)
Physical Review Letters
, vol.97
, Issue.16
, pp. 165502
-
-
Morishita, T.1
-
34
-
-
77954346669
-
-
10.1038/nphys1683
-
G. G. Simeoni, T. Bryk, F. A. Gorelli, M. Krisch, G. Ruocco, M. Santoro, and T. Scopigno, Nat. Phys. 6, 503 (2010). 10.1038/nphys1683
-
(2010)
Nat. Phys.
, vol.6
, pp. 503
-
-
Simeoni, G.G.1
Bryk, T.2
Gorelli, F.A.3
Krisch, M.4
Ruocco, G.5
Santoro, M.6
Scopigno, T.7
-
35
-
-
4344714853
-
-
10.1103/PhysRevLett.93.047801
-
N. Giovambattista, C. A. Angell, F. Sciortino, and H. E. Stanley, Phys. Rev. Lett. 93 (4), 047801 (2004). 10.1103/PhysRevLett.93.047801
-
(2004)
Phys. Rev. Lett.
, vol.93
, Issue.4
, pp. 047801
-
-
Giovambattista, N.1
Angell, C.A.2
Sciortino, F.3
Stanley, H.E.4
-
36
-
-
0036836445
-
-
10.1016/S0167-7322(02)00094-6
-
B. J. Guillot, J. Mol. Liq. 101, 219 (2002). 10.1016/S0167-7322(02)00094- 6
-
(2002)
J. Mol. Liq.
, vol.101
, pp. 219
-
-
Guillot, B.J.1
-
37
-
-
0142025560
-
-
10.1021/cr00019a014
-
H. Ohtaki and T. Radnai, Chem. Rev. 93, 1157 (1993). 10.1021/cr00019a014
-
(1993)
Chem. Rev.
, vol.93
, pp. 1157
-
-
Ohtaki, H.1
Radnai, T.2
-
38
-
-
38849196324
-
Water as an active constituent in cell biology
-
DOI 10.1021/cr068037a
-
P. Ball, Chem. Rev. 108, 74 (2008). 10.1021/cr068037a (Pubitemid 351187472)
-
(2008)
Chemical Reviews
, vol.108
, Issue.1
, pp. 74-108
-
-
Ball, P.1
-
39
-
-
51049107909
-
-
10.1063/1.2968550
-
M. Leetmaa, K. T. Wikfeldt, M. P. Ljungberg, M. Odelius, J. Swenson, A. Nilsson, and L. G. M. Pettersson, J. Chem. Phys. 129, 084502 (2008). 10.1063/1.2968550
-
(2008)
J. Chem. Phys.
, vol.129
, pp. 084502
-
-
Leetmaa, M.1
Wikfeldt, K.T.2
Ljungberg, M.P.3
Odelius, M.4
Swenson, J.5
Nilsson, A.6
Pettersson, L.G.M.7
-
40
-
-
66349096055
-
-
10.1021/jp9007619
-
K. T. Wikfeldt, M. Leetmaa, M. P. Ljungberg, A. Nilsson, and L. G. M. Pettersson, J. Phys. Chem. B 113, 6246 (2009). 10.1021/jp9007619
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 6246
-
-
Wikfeldt, K.T.1
Leetmaa, M.2
Ljungberg, M.P.3
Nilsson, A.4
Pettersson, L.G.M.5
-
41
-
-
34547458530
-
Joint structure refinement of x-ray and neutron diffraction data on disordered materials: Application to liquid water
-
DOI 10.1088/0953-8984/19/33/335206, PII S0953898407461525
-
A. K. Soper, J. Phys.: Condens. Matter 19, 335206 (2007). 10.1088/0953-8984/19/33/335206 (Pubitemid 47168257)
-
(2007)
Journal of Physics Condensed Matter
, vol.19
, Issue.33
, pp. 335206
-
-
Soper, A.K.1
-
42
-
-
77949607233
-
-
10.1063/1.3330752
-
K. T. Wikfeldt, M. Leetmaa, A. Mace, A. Nilsson, and L. G. M. Pettersson, J. Chem. Phys. 132, 104513 (2010). 10.1063/1.3330752
-
(2010)
J. Chem. Phys.
, vol.132
, pp. 104513
-
-
Wikfeldt, K.T.1
Leetmaa, M.2
MacE, A.3
Nilsson, A.4
Pettersson, L.G.M.5
-
44
-
-
79551691568
-
-
10.1080/00268976.2010.520040
-
J. Neuefeind, C. J. Benmore, J. K. R. Weber, and D. Paschek, Mol. Phys. 109, 279 (2011). 10.1080/00268976.2010.520040
-
(2011)
Mol. Phys.
, vol.109
, pp. 279
-
-
Neuefeind, J.1
Benmore, C.J.2
Weber, J.K.R.3
Paschek, D.4
-
45
-
-
79958856284
-
-
(unpublished)
-
C. Huang, K. T. Wikfeldt, D. Nordlund, U. Bergmann, T. McQueen, J. Sellberg, L. G. M. Pettersson, and A. Nilsson (unpublished).
-
-
-
Huang, C.1
Wikfeldt, K.T.2
Nordlund, D.3
Bergmann, U.4
McQueen, T.5
Sellberg, J.6
Pettersson, L.G.M.7
Nilsson, A.8
-
47
-
-
33846067146
-
Are recent water models obtained by fitting diffraction data consistent with infrared/Raman and x-ray absorption spectra?
-
DOI 10.1063/1.2408419
-
M. Leetmaa, M. Ljungberg, H. Ogasawara, M. Odelius, L.-. Nslund, A. Nilsson, and L. G. M. Pettersson, J. Chem. Phys. 125, 244510 (2006). 10.1063/1.2408419 (Pubitemid 46058281)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.24
, pp. 244510
-
-
Leetmaa, M.1
Ljungberg, M.2
Ogasawara, H.3
Odelius, M.4
Naslund, L.-A.5
Nilsson, A.6
Pettersson, L.G.M.7
-
48
-
-
77954105839
-
-
10.1103/PhysRevLett.105.017802
-
W. Chen, X. Wu, and R. Car, Phys. Rev. Lett. 105, 017802 (2010). 10.1103/PhysRevLett.105.017802
-
(2010)
Phys. Rev. Lett.
, vol.105
, pp. 017802
-
-
Chen, W.1
Wu, X.2
Car, R.3
-
49
-
-
33744730795
-
X-ray absorption spectra of water from first principles calculations
-
DOI 10.1103/PhysRevLett.96.215502
-
D. Prendergast and G. Galli, Phys. Rev. Lett. 96, 215502 (2006). 10.1103/PhysRevLett.96.215502 (Pubitemid 43824656)
-
(2006)
Physical Review Letters
, vol.96
, Issue.21
, pp. 215502
-
-
Prendergast, D.1
Galli, G.2
-
50
-
-
77950520853
-
-
10.1016/j.elspec.2010.02.004
-
M. Leetmaa, M. P. Ljungberg, A. P. Lyubartsev, A. Nilsson, and L. G. M. Pettersson, J. Electron Spectrosc. Relat. Phenom. 177, 135 (2010). 10.1016/j.elspec.2010.02.004
-
(2010)
J. Electron Spectrosc. Relat. Phenom.
, vol.177
, pp. 135
-
-
Leetmaa, M.1
Ljungberg, M.P.2
Lyubartsev, A.P.3
Nilsson, A.4
Pettersson, L.G.M.5
-
52
-
-
0034662896
-
-
10.1016/S0301-0104(00)00189-0
-
S. S. Xantheas, Chem. Phys. 258, 225 (2000). 10.1016/S0301-0104(00)00189- 0
-
(2000)
Chem. Phys.
, vol.258
, pp. 225
-
-
Xantheas, S.S.1
-
53
-
-
20844459075
-
The hydrogen bond in ice probed by soft x-ray spectroscopy and density functional theory
-
DOI 10.1063/1.1879752, 154505
-
A. Nilsson, H. Ogasawara, M. Cavalleri, D. Nordlund, M. Nyberg, P. Wernet, and L. G. M. Pettersson, J. Chem. Phys. 122 (15), 154505 (2005). 10.1063/1.1879752 (Pubitemid 40858271)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.15
, pp. 1-9
-
-
Nilsson, A.1
Ogasawara, H.2
Cavalleri, M.3
Nordlund, D.4
Nyberg, M.5
Wernet, Ph.6
Pettersson, L.G.M.7
-
54
-
-
78751546212
-
-
10.1063/1.3521268
-
J. Wang, G. Romn-Pérez, J. M. Soler, E. Artacho, and M.-V. Fernndez-Serra, J. Chem. Phys. 134, 024516 (2011). 10.1063/1.3521268
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 024516
-
-
Wang, J.1
Romn-Pérez, G.2
Soler, J.M.3
Artacho, E.4
Fernndez-Serra, M.-V.5
-
55
-
-
79958852650
-
-
Ab initio van der Waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like, J. Phys. Chem. B (submitted)
-
A. Mgelhj, A. Kelkkanen, K. T. Wikfeldt, J. Schitz, J. J. Mortensen, L. G. M. Pettersson, B. I. Lundqvist, K. W. Jacobsen, A. Nilsson, and J. K. Nrskov, Ab initio van der Waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like, J. Phys. Chem. B (submitted) http://arxiv.org/abs/1101.5666.
-
-
-
Mgelhj, A.1
Kelkkanen, A.2
Wikfeldt, K.T.3
Schitz, J.4
Mortensen, J.J.5
Pettersson, L.G.M.6
Lundqvist, B.I.7
Jacobsen, K.W.8
Nilsson, A.9
Nrskov, J.K.10
-
56
-
-
23844484216
-
Liquid-liquid phase transitions in supercooled water studied by computer simulations of various water models
-
DOI 10.1063/1.1992481, 044515
-
I. Brovchenko, A. Geiger, and A. Oleinikova, J. Chem. Phys. 123, 044515 (2005). 10.1063/1.1992481 (Pubitemid 41164747)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.4
, pp. 359-374
-
-
Brovchenko, I.1
Geiger, A.2
Oleinikova, A.3
-
59
-
-
28044455451
-
Relation between the Widom line and the dynamic crossover in systems with a liquid-liquid phase transition
-
DOI 10.1073/pnas.0507870102
-
L. Xu, P. Kumar, S. V. Buldyrev, S.-H. Chen, P. H. Poole, F. Sciortino, and H. E. Stanley, Proc. Natl. Acad. Sci. U.S.A. 102, 16558 (2005). 10.1073/pnas.0507870102 (Pubitemid 41688814)
-
(2005)
Proceedings of the National Academy of Sciences of the United States of America
, vol.102
, Issue.46
, pp. 16558-16562
-
-
Xu, L.1
Kumar, P.2
Buldyrev, S.V.3
Chen, S.-H.4
Poole, P.H.5
Sciortino, F.6
Stanley, H.E.7
-
61
-
-
0035825620
-
Generic mechanism for generating a liquid-liquid phase transition
-
DOI 10.1038/35055514
-
G. Franzese, G. Malescio, A. Skibinsky, S. V. Buldyrev, and H. E. Stanley, Nature (London) 409, 692 (2001). 10.1038/35055514 (Pubitemid 32144510)
-
(2001)
Nature
, vol.409
, Issue.6821
, pp. 692-695
-
-
Franzese, G.1
Malescio, G.2
Skibinsky, A.3
Buldyrev, S.V.4
Stanley, H.E.5
-
62
-
-
0037061093
-
Liquid-liquid phase transition in one-component fluids
-
DOI 10.1088/0953-8984/14/9/308, PII S0953898402324408
-
G. Malescio, G. Franzese, G. Pellicane, A. Skibinsky, S. V. Buldyrev, and H. E. Stanley, J. Phys.: Condens. Matter 14, 2193 (2002). 10.1088/0953-8984/14/ 9/308 (Pubitemid 34255450)
-
(2002)
Journal of Physics Condensed Matter
, vol.14
, Issue.9
, pp. 2193-2200
-
-
Malescio, G.1
Franzese, G.2
Pellicane, G.3
Skibinsky, A.4
Buldyrev, S.V.5
Stanley, H.E.6
-
65
-
-
29244471731
-
A general purpose model for the condensed phases of water: TIP4P/2005
-
DOI 10.1063/1.2121687, 234505
-
J. L. F. Abascal and C. Vega, J. Chem. Phys. 123, 234505 (2005). 10.1063/1.2121687 (Pubitemid 41828986)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.23
, pp. 1-12
-
-
Abascal, J.L.F.1
Vega, C.2
-
66
-
-
67650739279
-
-
10.1080/00268970902784926
-
H. L. Pi, J. L. Aragones, C. Vega, E. G. Noya, J. L. F. Abascal, M. A. Gonzalez, and C. McBride, Mol. Phys. 107, 365 (2009). 10.1080/00268970902784926
-
(2009)
Mol. Phys.
, vol.107
, pp. 365
-
-
Pi, H.L.1
Aragones, J.L.2
Vega, C.3
Noya, E.G.4
Abascal, J.L.F.5
Gonzalez, M.A.6
McBride, C.7
-
67
-
-
57449109985
-
-
10.1039/b805531a
-
C. Vega, J. L. F. Abascal, M. M. Conde, and J. L. Aragones, Faraday Discuss. 141, 251 (2009). 10.1039/b805531a
-
(2009)
Faraday Discuss.
, vol.141
, pp. 251
-
-
Vega, C.1
Abascal, J.L.F.2
Conde, M.M.3
Aragones, J.L.4
-
68
-
-
77956293023
-
-
10.1073/pnas.1006599107
-
G. N. I. Clark, G. Hura, J. Teixeira, A. K. Soper, and T. Head-Gordon, Proc. Natl. Acad. Sci. U.S.A. 107, 14003 (2010). 10.1073/pnas.1006599107
-
(2010)
Proc. Natl. Acad. Sci. U.S.A.
, vol.107
, pp. 14003
-
-
Clark, G.N.I.1
Hura, G.2
Teixeira, J.3
Soper, A.K.4
Head-Gordon, T.5
-
69
-
-
2942622288
-
-
10.1063/1.1683075
-
H. W. Horn, W. C. Swope, J. W. Pitera, J. D. Madura, T. J. Dick, G. L. Hura, and T. Head-Gordon, J. Chem. Phys. 120, 9665 (2004). 10.1063/1.1683075
-
(2004)
J. Chem. Phys.
, vol.120
, pp. 9665
-
-
Horn, H.W.1
Swope, W.C.2
Pitera, J.W.3
Madura, J.D.4
Dick, T.J.5
Hura, G.L.6
Head-Gordon, T.7
-
73
-
-
34250006059
-
Effect of confinement on the liquid-liquid phase transition of supercooled water
-
DOI 10.1063/1.2734963
-
I. Brovchenko and A. Oleinikova, J. Chem. Phys. 126, 214701 (2007). 10.1063/1.2734963 (Pubitemid 46887353)
-
(2007)
Journal of Chemical Physics
, vol.126
, Issue.21
, pp. 214701
-
-
Brovchenko, I.1
Oleinikova, A.2
-
74
-
-
0037020221
-
-
10.1016/S0009-2614(02)00890-4
-
M. Cavalleri, H. Ogasawara, L. G. M. Pettersson, and A. Nilsson, Chem. Phys. Lett. 364, 363 (2002). 10.1016/S0009-2614(02)00890-4
-
(2002)
Chem. Phys. Lett.
, vol.364
, pp. 363
-
-
Cavalleri, M.1
Ogasawara, H.2
Pettersson, L.G.M.3
Nilsson, A.4
-
75
-
-
44449122865
-
X-ray absorption spectra of hexagonal ice and liquid water by all-electron Gaussian and augmented plane wave calculations
-
DOI 10.1063/1.2928842
-
M. Iannuzzi, J. Chem. Phys. 128, 204506 (2008). 10.1063/1.2928842 (Pubitemid 351770635)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.20
, pp. 204506
-
-
Iannuzzi, M.1
-
76
-
-
79551578226
-
-
10.1103/PhysRevB.83.024201
-
L. Liang, P. Rulis, L. Z. Ouyang, and W. Y. Ching, Phys. Rev. B 83 (2), 024201 (2011). 10.1103/PhysRevB.83.024201
-
(2011)
Phys. Rev. B
, vol.83
, Issue.2
, pp. 024201
-
-
Liang, L.1
Rulis, P.2
Ouyang, L.Z.3
Ching, W.Y.4
-
78
-
-
79958825421
-
-
See supplementary material at E-JCPSA6-134-025121 for details
-
See supplementary material at http://dx.doi.org/10.1063/1.3594545 E-JCPSA6-134-025121 for details.
-
-
-
-
79
-
-
0000648454
-
-
10.1103/PhysRevE.54.R5897
-
J. Horbach, W. Kob, K. Binder, and C. A. Angell, Phys. Rev. E 54, R5897 (1996). 10.1103/PhysRevE.54.R5897
-
(1996)
Phys. Rev. e
, vol.54
, pp. 5897
-
-
Horbach, J.1
Kob, W.2
Binder, K.3
Angell, C.A.4
-
80
-
-
84943502952
-
-
10.1080/00268978400101201
-
S. Nosé, Mol. Phys. 52, 255 (1984). 10.1080/00268978400101201
-
(1984)
Mol. Phys.
, vol.52
, pp. 255
-
-
Nosé, S.1
-
81
-
-
0001538909
-
-
10.1103/PhysRevA.31.1695
-
W. G. Hoover, Phys. Rev. A 31, 1695 (1985). 10.1103/PhysRevA.31.1695
-
(1985)
Phys. Rev. A
, vol.31
, pp. 1695
-
-
Hoover, W.G.1
-
82
-
-
0019707626
-
Polymorphic transitions in single crystals: A new molecular dynamics method
-
DOI 10.1063/1.328693
-
M. Parrinello and A. Rahman, J. Appl. Phys. 52, 7182 (1981). 10.1063/1.328693 (Pubitemid 12456820)
-
(1981)
Journal of Applied Physics
, vol.52
, Issue.12
, pp. 7182-7190
-
-
Parrinello, M.1
Rahman, A.2
-
84
-
-
27344454932
-
GROMACS: Fast, flexible, and free
-
DOI 10.1002/jcc.20291
-
D. Van Der Spoel, E. Lindahl, B. Hess, G. Groenhof, A. E. Mark, and H. J. C. Berendsen, J. Comp. Chem. 26, 1701 (2005). 10.1002/jcc.20291 (Pubitemid 43076182)
-
(2005)
Journal of Computational Chemistry
, vol.26
, Issue.16
, pp. 1701-1718
-
-
Van Der Spoel, D.1
Lindahl, E.2
Hess, B.3
Groenhof, G.4
Mark, A.E.5
Berendsen, H.J.C.6
-
87
-
-
70450248561
-
-
10.1063/1.3259882
-
A. Cunsolo, F. Formisano, C. Ferrero, F. Bencivenga, and S. Finet, J. Chem. Phys. 131, 194502 (2009). 10.1063/1.3259882
-
(2009)
J. Chem. Phys.
, vol.131
, pp. 194502
-
-
Cunsolo, A.1
Formisano, F.2
Ferrero, C.3
Bencivenga, F.4
Finet, S.5
-
90
-
-
33746311995
-
Vapor-liquid equilibria from the triple point up to the critical point for the new generation of TIP4P-like models: TIP4P/Ew, TIP4P/2005, and TIP4P/ice
-
DOI 10.1063/1.2215612
-
C. Vega, J. L. Abascal, and I. Nezbeda, J. Chem. Phys. 125, 34503 (2006). 10.1063/1.2215612 (Pubitemid 44107144)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.3
, pp. 034503
-
-
Vega, C.1
Abascal, J.L.F.2
Nezbeda, I.3
-
91
-
-
9644266774
-
A large-scale molecular dynamics study of dynamic structure factor and dispersion relation of acoustic mode in liquid and supercritical water
-
DOI 10.1016/j.fluid.2004.10.015, PII S037838120400490X
-
T. Komatsu, N. Yoshii, S. Miura, and S. Okazaki, Fluid Phase Equilib. 226, 345 (2004). 10.1016/j.fluid.2004.10.015 (Pubitemid 39575434)
-
(2004)
Fluid Phase Equilibria
, vol.226
, Issue.1-2
, pp. 345-350
-
-
Komatsu, T.1
Yoshii, N.2
Miura, S.3
Okazaki, S.4
-
92
-
-
34447133705
-
Observation of the density minimum in deeply supercooled confined water
-
DOI 10.1073/pnas.0701352104
-
D. Liu, Y. Zhang, C.-C. Chen, C.-Y. Mou, P. H. Poole, and S.-H. Chen, Proc. Natl. Acad. Sci. U.S.A. 104, 9570 (2007). 10.1073/pnas.0701352104 (Pubitemid 47175307)
-
(2007)
Proceedings of the National Academy of Sciences of the United States of America
, vol.104
, Issue.23
, pp. 9570-9574
-
-
Liu, D.1
Zhang, Y.2
Chen, C.-G.3
Mou, C.-Y.4
Poole, P.H.5
Chen, S.-H.6
-
93
-
-
0000685148
-
-
10.1080/002689798169195
-
P.-L. Chau and A. J. Hardwick, Mol. Phys. 93 (3), 511 (1998). 10.1080/002689798169195
-
(1998)
Mol. Phys.
, vol.93
, Issue.3
, pp. 511
-
-
Chau, P.-L.1
Hardwick, A.J.2
-
94
-
-
49249086601
-
-
10.1103/PhysRevLett.101.065502
-
A. K. Soper and C. J. Benmore, Phys. Rev. Lett. 101, 065502 (2008). 10.1103/PhysRevLett.101.065502
-
(2008)
Phys. Rev. Lett.
, vol.101
, pp. 065502
-
-
Soper, A.K.1
Benmore, C.J.2
-
95
-
-
0000170769
-
Structures of high-density and low-density water
-
DOI 10.1103/PhysRevLett.84.2881, 2881
-
A. K. Soper and M. A. Ricci, Phys. Rev. Lett. 84 (13), 2881 (2000). 10.1103/PhysRevLett.84.2881 (Pubitemid 40598922)
-
(2000)
Physical Review Letters
, vol.84
, Issue.13
, pp. 2881-2884
-
-
Soper, A.K.1
Ricci, M.A.2
-
98
-
-
0002890497
-
-
10.1016/0009-2614(94)00318-1
-
H. gren, V. Carravetta, O. Vahtras, and L. G. M. Pettersson, Chem. Phys. Lett. 222, 75 (1994). 10.1016/0009-2614(94)00318-1
-
(1994)
Chem. Phys. Lett.
, vol.222
, pp. 75
-
-
Gren, H.1
Carravetta, V.2
Vahtras, O.3
Pettersson, L.G.M.4
-
101
-
-
36849140788
-
-
10.1063/1.1696113
-
S. Huzinaga, J. Chem. Phys. 42, 1293 (1965). 10.1063/1.1696113
-
(1965)
J. Chem. Phys.
, vol.42
, pp. 1293
-
-
Huzinaga, S.1
-
102
-
-
57049152283
-
-
10.1016/j.cplett.2008.10.088
-
J. S. Uejio, C. P. Schwartz, R. J. Saykally, and D. Prendergast, Chem. Phys. Lett. 467, 195 (2008). 10.1016/j.cplett.2008.10.088
-
(2008)
Chem. Phys. Lett.
, vol.467
, pp. 195
-
-
Uejio, J.S.1
Schwartz, C.P.2
Saykally, R.J.3
Prendergast, D.4
-
103
-
-
67249158867
-
-
10.1063/1.3125509
-
C. P. Schwartz, J. S. Uejio, R. J. Saykally, and D. Prendergast, J. Chem. Phys. 130, 184109 (2009). 10.1063/1.3125509
-
(2009)
J. Chem. Phys.
, vol.130
, pp. 184109
-
-
Schwartz, C.P.1
Uejio, J.S.2
Saykally, R.J.3
Prendergast, D.4
-
104
-
-
77949822707
-
-
10.1021/jp912208v
-
T. Pylkknen, V. M. Giordano, J.-C. Chervin, A. Sakko, M. Hakala, J. A. Soininen, K. Hmlinen, G. Monaco, and S. Huotari, J. Phys. Chem. B 114, 3804 (2010). 10.1021/jp912208v
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 3804
-
-
Pylkknen, T.1
Giordano, V.M.2
Chervin, J.-C.3
Sakko, A.4
Hakala, M.5
Soininen, J.A.6
Hmlinen, K.7
Monaco, G.8
Huotari, S.9
-
106
-
-
65649122604
-
-
10.1103/PhysRevB.79.132203
-
J. Forsberg, J. Grsj, B. Brena, J. Nordgren, L. C. Duda, and J. E. Rubensson, Phys. Rev. B 79, 132203 (2009). 10.1103/PhysRevB.79.132203
-
(2009)
Phys. Rev. B
, vol.79
, pp. 132203
-
-
Forsberg, J.1
Grsj, J.2
Brena, B.3
Nordgren, J.4
Duda, L.C.5
Rubensson, J.E.6
-
107
-
-
84958771620
-
-
10.1016/j.chemphys.2010.08.023
-
K. M. Lange, R. Knecke, S. Ghadimi, R. Golnak, M. A. Soldatov, K. F. Hodeck, A. Soldatov, and E. F. Aziz, Chem. Phys. 377, 1 (2010). 10.1016/j.chemphys.2010.08.023
-
(2010)
Chem. Phys.
, vol.377
, pp. 1
-
-
Lange, K.M.1
Knecke, R.2
Ghadimi, S.3
Golnak, R.4
Soldatov, M.A.5
Hodeck, K.F.6
Soldatov, A.7
Aziz, E.F.8
-
108
-
-
38349144335
-
-
10.1103/PhysRevLett.100.027801
-
O. Fuchs, M. Zharnikov, L. Weinhardt, M. Blum, M. Weigand, Y. Zubavichus, M. Br, F. Maier, J. D. Denlinger, C. Heske, M. Grunze, and E. Umbach, Phys. Rev. Lett. 100, 027801 (2008). 10.1103/PhysRevLett.100.027801
-
(2008)
Phys. Rev. Lett.
, vol.100
, pp. 027801
-
-
Fuchs, O.1
Zharnikov, M.2
Weinhardt, L.3
Blum, M.4
Weigand, M.5
Zubavichus, Y.6
Br, M.7
Maier, F.8
Denlinger, J.D.9
Heske, C.10
Grunze, M.11
Umbach, E.12
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