-
2
-
-
4243715300
-
-
Lehmann, J. F.; Mercier, H. P. A.; Schrobilgen, G. J. Coord. Chem. Rev. 2002, 233, 1-39.
-
(2002)
Coord. Chem. Rev.
, vol.233
, pp. 1-39
-
-
Lehmann, J.F.1
Mercier, H.P.A.2
Schrobilgen, G.J.3
-
7
-
-
0000062404
-
-
Agron, P. A.; Begun, G. M.; Levy, H. A.; Mason, A. A.; Jones, C. G.; Smith, D. F. Science 1963, 139, 842-844.
-
(1963)
Science
, vol.139
, pp. 842-844
-
-
Agron, P.A.1
Begun, G.M.2
Levy, H.A.3
Mason, A.A.4
Jones, C.G.5
Smith, D.F.6
-
9
-
-
77956506993
-
-
Elliot, H. S. A.; Lehmann, J. F.; Mercier, H. P. A.; Jenkins, H. D. B.; Schobilgen, G. J. Inorg. Chem. 2010, 49, 8504-8523.
-
(2010)
Inorg. Chem.
, vol.49
, pp. 8504-8523
-
-
Elliot, H.S.A.1
Lehmann, J.F.2
Mercier, H.P.A.3
Jenkins, H.D.B.4
Schobilgen, G.J.5
-
10
-
-
33749113333
-
-
Gillespie, R. J.; Robinson, R. J. Angew. Chem., Int. Ed. Engl. 1996, 35, 495-514.
-
(1996)
Angew. Chem., Int. Ed. Engl.
, vol.35
, pp. 495-514
-
-
Gillespie, R.J.1
Robinson, R.J.2
-
17
-
-
73349118834
-
-
Grant, D. J.; Wang, T.-H.; Dixon, D. A.; Christe, K. O. Inorg. Chem. 2010, 49, 261-270.
-
(2010)
Inorg. Chem.
, vol.49
, pp. 261-270
-
-
Grant, D.J.1
Wang, T.-H.2
Dixon, D.A.3
Christe, K.O.4
-
18
-
-
20944432209
-
-
Dixon, D. A.; de Jong, W. A.; Peterson, K. A.; Christe, K. O.; Schrobilgen, G. J. J. Am. Chem. Soc. 2005, 127, 8627.
-
(2005)
J. Am. Chem. Soc.
, vol.127
, pp. 8627
-
-
Dixon, D.A.1
De Jong, W.A.2
Peterson, K.A.3
Christe, K.O.4
Schrobilgen, G.J.5
-
21
-
-
33947088822
-
-
Bartlett, N.; Wechsberg, M.; Jones, G. R.; Burbank, R. D. Inorg. Chem. 1972, 11, 1124-1127.
-
(1972)
Inorg. Chem.
, vol.11
, pp. 1124-1127
-
-
Bartlett, N.1
Wechsberg, M.2
Jones, G.R.3
Burbank, R.D.4
-
22
-
-
0000595854
-
-
Bartlett, N.; Gennis, M.; Gibler, D. D.; Morell, B. K.; Zalkin, A. Inorg. Chem. 1973, 12, 1717-1721.
-
(1973)
Inorg. Chem.
, vol.12
, pp. 1717-1721
-
-
Bartlett, N.1
Gennis, M.2
Gibler, D.D.3
Morell, B.K.4
Zalkin, A.5
-
23
-
-
0000561562
-
-
Zalkin, A.; Ward, D. L.; Biagoni, R. N.; Tempelton, D. H.; Bartlett, N. Inorg. Chem. 1978, 17, 1318-1322.
-
(1978)
Inorg. Chem.
, vol.17
, pp. 1318-1322
-
-
Zalkin, A.1
Ward, D.L.2
Biagoni, R.N.3
Tempelton, D.H.4
Bartlett, N.5
-
24
-
-
77956046967
-
-
Kim, M.; Debessai, M.; Yoo, C.-S. Nat. Chem. 2010, 2, 784-788.
-
(2010)
Nat. Chem.
, vol.2
, pp. 784-788
-
-
Kim, M.1
Debessai, M.2
Yoo, C.-S.3
-
25
-
-
79955377815
-
-
The authors report that phase III has the same symmetry as phase IV with different ordering of the atoms. Therefore, in order to distinguish them, they mark the former as Pnnm-1 and the latter as Pnnm-2
-
The authors report that phase III has the same symmetry as phase IV with different ordering of the atoms. Therefore, in order to distinguish them, they mark the former as Pnnm-1 and the latter as Pnnm-2.
-
-
-
-
26
-
-
0001032057
-
-
Burbank, R. D.; Falconer, W. E.; Sunder, W. A. Science 1972, 178, 1285-1286.
-
(1972)
Science
, vol.178
, pp. 1285-1286
-
-
Burbank, R.D.1
Falconer, W.E.2
Sunder, W.A.3
-
27
-
-
79955408275
-
-
For a list of all structures studied, see the SI
-
For a list of all structures studied, see the SI.
-
-
-
-
29
-
-
37649030605
-
-
Somayazulu, M.; Madduri, A.; Goncharov, A. F.; Tschauner, O.; McMillan, P. F.; Mao, H.-k.; Hemley, R. J. Phys. Rev. Lett. 2001, 87, 135504-1-135504-1.
-
(2001)
Phys. Rev. Lett.
, vol.87
, pp. 1355041-1355041
-
-
Somayazulu, M.1
Madduri, A.2
Goncharov, A.F.3
Tschauner, O.4
McMillan, P.F.5
Mao, H.-K.6
Hemley, R.J.7
-
30
-
-
0038575884
-
-
Yoo, C. S.; Iota, V.; Cynn, H.; Nicol, M.; Park, J.-H.; Le Bihan, T.; Mezouar, M. J. Phys. Chem. B 2003, 107, 5922-5925.
-
(2003)
Phys. Chem. B
, vol.107
, pp. 5922-5925
-
-
Yoo, C.S.1
Iota, V.2
Cynn, H.3
Nicol, M.4
Park, J.-H.5
Le Bihan, T.6
Mezouar, M.J.7
-
31
-
-
0038814089
-
-
Song, Y.; Somayazulu, M.; Mao, H.-k.; Hemley, R. J.; Herschbach, D. R. J. Chem. Phys. 2003, 118, 8350-8356.
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 8350-8356
-
-
Song, Y.1
Somayazulu, M.2
Mao, H.-K.3
Hemley, R.J.4
Herschbach, D.R.5
-
32
-
-
1642265596
-
-
Iota, V.; Park, J.-H.; Yoo, C. S. Phys. Rev. B 2004, 69, 064106-1-064106-6.
-
(2004)
Phys. Rev. B
, vol.69
, pp. 0641061-0641066
-
-
Iota, V.1
Park, J.-H.2
Yoo, C.S.3
-
34
-
-
29544440378
-
-
Oganov, A. R.; Glass, C. W.; Ono, S. Earth Planet. Sci. Lett. 2006, 241, 95-103.
-
(2006)
Earth Planet. Sci. Lett.
, vol.241
, pp. 95-103
-
-
Oganov, A.R.1
Glass, C.W.2
Ono, S.3
-
36
-
-
79955442322
-
-
3 (pa3̄)
-
2 molecule at 50 GPa: 38.6 Å3 (i4/mmm), 38.7 Å3 (cmca), and 44.5 Å3 (pa3̄).
-
-
-
-
37
-
-
79955364418
-
-
The transformation between the face centered cell of I4/mmm and Pnnm-2 (z = 4) and the standard cell (z = 2) is simple with the cell vectors a, b, and c of the face centered cell equal respectively to a' + b', a' - b', and c', where a', b', and c' are the original vectors of the standard cell
-
The transformation between the face centered cell of I4/mmm and Pnnm-2 (z = 4) and the standard cell (z = 2) is simple with the cell vectors a, b, and c of the face centered cell equal respectively to a' + b', a' - b', and c', where a', b', and c' are the original vectors of the standard cell.
-
-
-
-
38
-
-
0011025471
-
-
2 is positive and equal to 144 kJ/mol at 0 GPa (compared to 151 kJ/mol found experimentally):, It increases to 358 kJ/mol at 100 GPa because of the positive sign of the p?V term(for details, see the SI).
-
An important experimental issue when dealing with XeF2 is its stability with respect to decomposition into Xe and F2. Kim et al. did not find signs of such a reaction taking places at high pressure.10 Indeed, our calculations indicate that the enthalpy of decomposition of solid XeF2 to solid Xe and F2 is positive and equal to 144 kJ/mol at 0 GPa (compared to 151 kJ/mol found experimentally): Johnson, G. K.; Malm, J. G.; Hubbard, W. N. J. Chem. Thermodyn. 1972, 4, 879-891. It increases to 358 kJ/mol at 100 GPa because of the positive sign of the p?V term(for details, see the SI).
-
(1972)
J. Chem. Thermodyn.
, vol.4
, pp. 879-891
-
-
Johnson, G.K.1
Malm, J.G.2
Hubbard, W.N.3
-
39
-
-
79955432488
-
-
Additionally, the Xe layers (expanding in the a-b plane) become slightly puckered, and the a and b cell vectors are differentiated (a lengthens and b becomes smaller), while c expands (see the SI).
-
Additionally, the Xe layers (expanding in the a-b plane) become slightly puckered, and the a and b cell vectors are differentiated (a lengthens and b becomes smaller), while c expands (see the SI).
-
-
-
-
41
-
-
79955425247
-
-
For pressure evolution of the Xe ⋯ F and F ⋯ F contacts in the I4/mmm and Pnma structures, see the SI
-
For pressure evolution of the Xe ⋯ F and F ⋯ F contacts in the I4/mmm and Pnma structures, see the SI.
-
-
-
-
42
-
-
31044433683
-
-
Häussermann, U.; Berastegui, P.; Carlson, S.; Haines, J.; Léger, J.-M. Angew. Chem. 2001, 113, 4760-4765.
-
(2001)
Angew. Chem.
, vol.113
, pp. 4760-4765
-
-
Häussermann, U.1
Berastegui, P.2
Carlson, S.3
Haines, J.4
Léger, J.-M.5
-
43
-
-
0001536818
-
-
The anti-NiAs structure type has been observed as one of the high-pressure phases of AgF
-
The anti-NiAs structure type has been observed as one of the high-pressure phases of AgF: Hull, S.; Berastegui, P. J. Phys.: Condens. Matter 1998, 10, 7945-7955.
-
(1998)
J. Phys.: Condens. Matter
, vol.10
, pp. 7945-7955
-
-
Hull, S.1
Berastegui, P.2
-
44
-
-
60149096355
-
-
Oganov, A. R.; Chen, J.; Gatti, X.; Ma, Y.; Ma, Y.; Glass, C. W.; Liu, Z.; Yu, T.; Kurakevych, O. O.; Solozhenko, V. L. Nature 2009, 457, 863-868.
-
(2009)
Nature
, vol.457
, pp. 863-868
-
-
Oganov, A.R.1
Chen, J.2
Gatti, X.3
Ma, Y.4
Ma, Y.5
Glass, C.W.6
Liu, Z.7
Yu, T.8
Kurakevych, O.O.9
Solozhenko, V.L.10
-
46
-
-
79955383459
-
-
Kriatchev, L., Ed.; Pan Stanford Publishing: Singapore
-
Grochala, W.; Kriatchev, L.; Räsänen, M. In Physics & Chemistry at Low Temperatures; Kriatchev, L., Ed.; Pan Stanford Publishing: Singapore, 2011; p 421.
-
(2011)
Physics & Chemistry at Low Temperatures
, pp. 421
-
-
Grochala, W.1
Kriatchev, L.2
Räsänen, M.3
-
48
-
-
0037623560
-
-
Jenkins, H. D. B.; Roobotoom, H. K.; Passmore, J. Inorg. Chem. 2003, 42, 2886-2893.
-
(2003)
Inorg. Chem.
, vol.42
, pp. 2886-2893
-
-
Jenkins, H.D.B.1
Roobotoom, H.K.2
Passmore, J.3
-
49
-
-
0000278584
-
-
Christe, K. O.; Dixon, D. A.; McLemore, D.; Wilson, W. W.; Sheehy, J. A.; Boatz, J. A. J. Fluorine Chem. 2000, 101, 151-153.
-
(2000)
J. Fluorine Chem.
, vol.101
, pp. 151-153
-
-
Christe, K.O.1
Dixon, D.A.2
McLemore, D.3
Wilson, W.W.4
Sheehy, J.A.5
Boatz, J.A.6
-
51
-
-
33745374559
-
-
Savin, A.; Jepsen, A.; Flad, J.; Andersen, O. K.; Preuss, H.; von Schnering, H. G. Angew. Chem., Int. Ed. Engl. 1992, 31, 187-188.
-
(1992)
Angew. Chem. Int. Ed. Engl.
, vol.31
, pp. 187-188
-
-
Savin, A.1
Jepsen, A.2
Flad, J.3
Andersen, O.K.4
Preuss, H.5
Von Schnering, H.G.6
-
52
-
-
0032575683
-
-
Eremets, M. I.; Shimizu, K.; Kobayashi, T. C.; Amaya, K. Science 1998, 281, 1333-1335.
-
(1998)
Science
, vol.281
, pp. 1333-1335
-
-
Eremets, M.I.1
Shimizu, K.2
Kobayashi, T.C.3
Amaya, K.4
-
54
-
-
4243943295
-
-
Perdew, J. P.; Burke, K.; Ernezrhof, M. Phys. Rev. Lett. 1997, 77, 3865-3868.
-
(1997)
Phys. Rev. Lett.
, vol.77
, pp. 3865-3868
-
-
Perdew, J.P.1
Burke, K.2
Ernezrhof, M.3
-
55
-
-
0141788105
-
-
Bonev, S. A.; Gygi, F.; Ogitsu, T.; Galli, G. Phys. Rev. Lett. 2003, 91, 065501-01-065501-04.
-
(2003)
Phys. Rev. Lett.
, vol.91
, pp. 06550101-06550104
-
-
Bonev, S.A.1
Gygi, F.2
Ogitsu, T.3
Galli, G.4
-
60
-
-
0041329260
-
-
Parliński, K.; Li, Z. Q.; Kawazoe, Y. Phys. Rev. Lett. 1997, 78, 4063-4066.
-
(1997)
Phys. Rev. Lett.
, vol.78
, pp. 4063-4066
-
-
Parliński, K.1
Li, Z.Q.2
Kawazoe, Y.3
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