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Author |
Govaerts, K.; Partoens, B.; Lamoen, D. |
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Title |
Extended homologous series of Sn–O layered systems: A first-principles study |
Type |
A1 Journal article |
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Year |
2016 |
Publication |
Solid state communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
243 |
Issue |
243 |
Pages |
36-43 |
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A1 Journal article; Electron microscopy for materials research (EMAT); Condensed Matter Theory (CMT) |
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Abstract |
Apart from the most studied tin-oxide compounds, SnO and SnO2, intermediate states have been claimed to exist for more than a hundred years. In addition to the known homologous series (Seko et al., Phys. Rev. Lett. 100, 045702 (2008)), we here predict the existence of several new compounds with an O concentration between 50 % (SnO) and 67 % (SnO2). All these intermediate compounds are constructed from removing one or more (101) oxygen layers of SnO2. Since the van der Waals (vdW) interaction is known to be important for the Sn-Sn interlayer distances, we use a vdW-corrected functional, and compare these results with results obtained with PBE and hybrid functionals. We present the electronic properties of the intermediate structures and we observe a decrease of the band gap when (i) the O concentration increases and (ii) more SnO-like units are present for a given concentration. The contribution of the different atoms to the valence and conduction band is also investigated. |
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Wos |
000381544200007 |
Publication Date |
2016-06-12 |
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ISSN |
0038-1098 |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
10 |
Open Access |
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Notes |
We gratefully acknowledge financial support from a GOA fund of the University of Antwerp. K.G. thanks the University of Antwerp for a PhD fellowship. The computational resources and services used in this work were provided by the VSC (Flemish Supercomputer Center) and the HPC infrastructure of the University of Antwerp (CalcUA), both funded by the Hercules Foundation and the Flemish Government – department EWI. |
Approved |
Most recent IF: 1.554 |
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Call Number |
c:irua:134037 |
Serial |
4085 |
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Author |
Misko, V.R.; Fomin, V.M.; Devreese, J.T.; Moshchalkov, V.V. |
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Title |
On the Ginzburg-Landau analysis of a mixed s-dx2-y2-wave superconducting mesoscopic square |
Type |
A1 Journal article |
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Year |
2000 |
Publication |
Solid State Communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
114 |
Issue |
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Pages |
499-504 |
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Keywords ![sorted by Keywords field, ascending order (up)](img/sort_asc.gif) |
A1 Journal article; Electron Microscopy for Materials Science (EMAT); |
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Place of Publication |
New York, N.Y. |
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Wos |
000086679000011 |
Publication Date |
2002-07-26 |
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ISSN |
0038-1098; |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
2 |
Open Access |
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Approved |
Most recent IF: 1.554; 2000 IF: 1.271 |
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Call Number |
UA @ lucian @ c:irua:29033 |
Serial |
2436 |
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Author |
Fomin, V.M.; Misko, V.R.; Devreese, J.T.; Moshchalkov, V.V. |
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Title |
On the superconducting phase boundary for a mesoscopic square loop |
Type |
A1 Journal article |
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Year |
1997 |
Publication |
Solid State Communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
101 |
Issue |
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Pages |
303-308 |
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Keywords ![sorted by Keywords field, ascending order (up)](img/sort_asc.gif) |
A1 Journal article; Electron Microscopy for Materials Science (EMAT); |
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Place of Publication |
New York, N.Y. |
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Wos |
A1997WB80400001 |
Publication Date |
0000-00-00 |
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ISSN |
0038-1098 |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
39 |
Open Access |
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Notes |
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Approved |
Most recent IF: 1.554; 1997 IF: 1.323 |
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Call Number |
UA @ lucian @ c:irua:20355 |
Serial |
2456 |
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Author |
Ivanov, V.A.; Misko, V.R.; Fomin, V.M.; Devreese, J.T. |
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Title |
Superconductivity in mesoscopic high-Tc superconducting particles |
Type |
A1 Journal article |
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Year |
2003 |
Publication |
Solid State Communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
125 |
Issue |
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Pages |
439-444 |
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Keywords ![sorted by Keywords field, ascending order (up)](img/sort_asc.gif) |
A1 Journal article; Electron Microscopy for Materials Science (EMAT); |
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Place of Publication |
New York, N.Y. |
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Wos |
000181023700017 |
Publication Date |
2003-01-30 |
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ISSN |
0038-1098; |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
3 |
Open Access |
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Notes |
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Approved |
Most recent IF: 1.554; 2003 IF: 1.602 |
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Call Number |
UA @ lucian @ c:irua:40871 |
Serial |
3372 |
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Author |
Shanenko, A.A.; Tempère, J.; Brosens, F.; Devreese, J.T. |
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Title |
Mesoscopic samples: the superconducting condensate via the Gross.Pitaevskii scenario |
Type |
A1 Journal article |
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Year |
2004 |
Publication |
Solid state communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
131 |
Issue |
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Pages |
409-414 |
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Keywords ![sorted by Keywords field, ascending order (up)](img/sort_asc.gif) |
A1 Journal article; Theory of quantum systems and complex systems; Condensed Matter Theory (CMT) |
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Place of Publication |
New York, N.Y. |
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Wos |
000223011700012 |
Publication Date |
2004-03-20 |
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ISSN |
0038-1098; |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
1 |
Open Access |
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Notes |
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Approved |
Most recent IF: 1.554; 2004 IF: 1.523 |
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Call Number |
UA @ lucian @ c:irua:48282 |
Serial |
2000 |
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Permanent link to this record |
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Author |
Brosens, F.; Magnus, W. |
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Title |
Newtonian trajectories : a powerful tool for solving quantum dynamics |
Type |
A1 Journal article |
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Year |
2010 |
Publication |
Solid state communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
150 |
Issue |
43/44 |
Pages |
2102-2105 |
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Keywords ![sorted by Keywords field, ascending order (up)](img/sort_asc.gif) |
A1 Journal article; Theory of quantum systems and complex systems; Condensed Matter Theory (CMT) |
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Abstract |
Since Ehrenfests theorem, the role and importance of classical paths in quantum dynamics have been examined by several means. Along this line, we show that the classical equations of motion provide a solution to quantum dynamics, if appropriately incorporated into the Wigner distribution function, exactly reformulated in a type of Boltzmann equation. Also the quantum-mechanical features of the canonical ensemble can be studied in this framework of Newtonian dynamics, if the initial distribution function is appropriately constructed from the statistical operator. |
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Place of Publication |
New York, N.Y. |
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Wos |
000284251700006 |
Publication Date |
2010-09-20 |
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Edition |
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ISSN |
0038-1098; |
ISBN |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
7 |
Open Access |
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Notes |
; The authors thank J.T. Devreese and J. Tempere for interesting and helpful discussions, and, in particular, L.F. Lemmens for several valuable suggestions. One of the authors (F.B.) acknowledges the FWO projects G.0115.06 and G.0365.08 as well as the WOG project WO.033.09N, for financial support. ; |
Approved |
Most recent IF: 1.554; 2010 IF: 1.981 |
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Call Number |
UA @ lucian @ c:irua:85795 |
Serial |
2338 |
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Permanent link to this record |
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Author |
Croitoru, M.D.; Gladilin, V.N.; Fomin, V.M.; Devreese, J.T.; Magnus, W.; Schoenmaker, W.; Sorée, B. |
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Title |
Quantum transport in an ultra-thin SOI MOSFET: influence of the channel thickness on the I-V characteristics |
Type |
A1 Journal article |
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Year |
2008 |
Publication |
Solid state communications |
Abbreviated Journal |
Solid State Commun |
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Volume |
147 |
Issue |
1/2 |
Pages |
31-35 |
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Keywords ![sorted by Keywords field, ascending order (up)](img/sort_asc.gif) |
A1 Journal article; Theory of quantum systems and complex systems; Condensed Matter Theory (CMT); Electron microscopy for materials research (EMAT) |
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Place of Publication |
New York, N.Y. |
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Language |
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Wos |
000257220400009 |
Publication Date |
2008-04-26 |
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Series Volume |
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Series Issue |
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Edition |
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ISSN |
0038-1098; |
ISBN |
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Additional Links |
UA library record; WoS full record; WoS citing articles |
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Impact Factor |
1.554 |
Times cited |
8 |
Open Access |
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Notes |
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Approved |
Most recent IF: 1.554; 2008 IF: 1.557 |
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Call Number |
UA @ lucian @ c:irua:69748 |
Serial |
2794 |
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Permanent link to this record |