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Number of items at this level: 21.

A

Agoston, Peter and Albe, Karsten :
Thermodynamic stability, stoichiometry, and electronic structure of bcc-In2O3 surfaces.
[Online-Edition: http://prb.aps.org/abstract/PRB/v84/i4/e045311]
In: Phys. Rev. B, 84 (045311) pp. 1-20.
[Article] , (2011)
Note:

SFB 595 C2

Agoston, Peter and Albe, Karsten :
Disordered reconstructions of the reduced SnO2-(110) surface.
[Online-Edition: http://www.sciencedirect.com/science/article/pii/S0039602811...]
In: Surf. Sci., 605 (7-8) pp. 714-722.
[Article] , (2011)
Note:

SFB 595 C2

Agoston, Peter and Koerber, Christoph and Klein, Andreas and Puska, Martti J. and Nieminen, Risto M. and Albe, Karsten :
Limits for n-type doping in In2O3 and SnO2: A theoretical approach by first-principles calculations using hybrid-functional methodology.
[Online-Edition: http://jap.aip.org/resource/1/japiau/v108/i5/p053511_s1]
In: Journal of Applied Physics, 108 (5) 053511. ISSN 00218979
[Article] , (2010)
Note:

SFB 595 Cooperation C2, D3

Agoston, Peter and Albe, Karsten :
Ab initio modeling of diffusion in indium oxide.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.81.195205]
In: Physical Review B, 81 (19) pp. 195205-11. ISSN 1098-0121
[Article] , (2010)
Note:

SFB 595 C2

Agoston, Peter and Erhart, Paul and Klein, Andreas and Albe, Karsten :
Geometry, electronic structure and thermodynamic stability of intrinsic point defects in indium oxide.
[Online-Edition: http://iopscience.iop.org/0953-8984/21/45/455801/]
In: Journal of Physics: Condensed Matter, 21 (45) pp. 455801-1. ISSN 0953-8984
[Article] , (2009)
Note:

SFB 595 Cooperation C2, D3

Agoston, Peter and Albe, Karsten :
Formation entropies of intrinsic point defects in cubic In2O3 from first-principles density functional theory calculations.
[Online-Edition: http://pubs.rsc.org/en/Content/ArticleLanding/2009/CP/b90028...]
In: Phys. Chem. Chem. Phys., 11 (17) pp. 3226-3232.
[Article] , (2009)
Note:

SFB 595 C2

Albe, Karsten and Erhart, P. and Müller, M. :
Analytic Interatomic Potentials for Atomic-Scale Simulations of Metals and Metal Compounds: A Brief Overview.
[Online-Edition: http://dx.doi.org/10.1002/9783527610983.ch16]
In: ntegral Materials Modeling: Towards Physics-Based Through-Process Models (16) pp. 197-206.
[Article] , (2007)
Note:

SFB 595 C2

E

Erhart, Paul and Eichel, Rüdiger-A. and Träskelin, Petra and Albe, Karsten :
Association of oxygen vacancies with impurity metal ions in lead titanate.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.76.174116]
In: Physical review / B, 76 (17) 174116-1-174116-12.
[Article] , (2007)
Note:

SFB 595 Cooperation B1, C1, C2

Erhart, Paul and Klein, Andreas and Egdell, Russell and Albe, Karsten :
Band structure of indium oxide: Indirect versus direct band gap.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.75.153205]
In: Physical Review B, 75 (15) pp. 153205-1. ISSN 1098-0121
[Article] , (2007)
Note:

SFB 595 Cooperation C2, D3

Erhart, Paul and Juslin, Niklas and Goy, Oliver and Nordlund, Kai and Müller, Ralf and Albe, Karsten :
Analytic bond-order potential for atomistic simulations of zinc oxide.
[Online-Edition: http://dx.doi.org/10.1088/0953-8984/18/29/003]
In: Journal of Physics: Condensed Matter, 18 (29) pp. 6585-6605. ISSN 0953-8984
[Article] , (2006)
Note:

SFB 595 Cooperation C2, C3

Erhart, Paul and Albe, Karsten and Klein, Andreas :
First-principles study of intrinsic point defects in ZnO: Role of band structure, volume relaxation, and finite-size effects.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.73.205203]
In: Physical Review B, 73 (20) pp. 205203-1. ISSN 1098-0121
[Article] , (2006)
Note:

SFB 595 Cooperation C2, D3

Erhart, Paul and Albe, Karsten :
Diffusion of zinc vacancies and interstitials in zinc oxide.
[Online-Edition: http://dx.doi.org/10.1063/1.2206559]
In: Applied Physics Letters, 88 (20) 201918-1-201918-3. ISSN 00036951
[Article] , (2006)
Note:

SFB 595 C2

Erhart, Paul and Albe, Karsten :
First-principles study of migration mechanisms and diffusion of oxygen in zinc oxide.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.73.115207]
In: Physical Review B, 73 (11) pp. 115207-1. ISSN 1098-0121
[Article] , (2006)
Note:

SFB 595 C2

Erhart, Paul and Klein, Andreas and Albe, Karsten :
First-principles study of the structure and stability of oxygen defects in zinc oxide.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.72.085213]
In: Physical Review B, 72 (8) 085213-1-085213-7. ISSN 1098-0121
[Article] , (2005)
Note:

SFB 595 Cooperation C2, D3

G

Gassmann, Andrea and Yampolskii, Sergey V. and Klein, Andreas and Albe, Karsten and Vilbrandt, Nicole and Pekkola, Oili and Genenko, Yuri A. and Rehahn, Matthias and von Seggern, Heinz :
Study of electrical fatigue by defect engineering in organic light-emitting diodes.
[Online-Edition: http://dx.doi.org/10.1016/j.mseb.2014.10.014]
In: Materials Science and Engineering: B, 192 pp. 26-51. ISSN 09215107
[Article] , (2015)
Note:

SFB 595 Cooperation A5, C2, C5, D3, D4

J

Juslin, N. and Erhart, P. and Traskelin, P. and Nord, J. and Henriksson, K. O. E. and Nordlund, K. and Salonen, E. and Albe, K. :
Analytical interatomic potential for modeling nonequilibrium processes in the W-C-H system.
[Online-Edition: http://jap.aip.org/resource/1/japiau/v98/i12/p123520_s1]
In: J. Appl. Phys., 98 (12) pp. 123520-1. ISSN 0021-8979
[Article] , (2005)
Note:

SFB 595 C2

K

Körber, Christoph and Ágoston, Péter and Klein, Andreas :
Surface and bulk properties of sputter deposited undoped and Sb-doped SnO2 thin films.
[Online-Edition: http://dx.doi.org/10.1016/j.snb.2009.03.067]
In: Sensors and Actuators B: Chemical, 139 (2) pp. 665-672. ISSN 09254005
[Article] , (2009)
Note:

SFB 595 Cooperation C2, D3

M

Mueller, Michael and Erhart, Paul and Albe, Karsten :
Analytic bond-order potential for bcc and fcc iron - comparison with established embedded-atom method potentials.
[Online-Edition: http://iopscience.iop.org/0953-8984/19/32/326220/]
In: J. Phys.: Condens. Mater., 19 (32) 326220-1-326220-23.
[Article] , (2007)
Note:

SFB 595 C2

N

Nord, J. and Albe, K. and Erhart, P. and Nordlund, K. :
Modelling of compound semiconductors: analytical bond-order potential for gallium, nitrogen and gallium nitride.
[Online-Edition: http://iopscience.iop.org/0953-8984/15/32/324/]
In: J. Phys.: Condens. Matter., 15 (32) pp. 5649-5662.
[Article] , (2003)
Note:

SFB 595 C2

Á

Ágoston, Péter and Albe, Karsten and Nieminen, Risto M. and Puska, Martti J. :
Ágoston et al. Reply: Comment on "Intrinsic n-type Behavior in Transparent Conducting Oxides: A Comparative Hybrid-Functional Study of In2O3, SnO2 and ZnO”.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevLett.106.069602]
In: Physical Review Letters, 106 (6) 069602(1-1). ISSN 0031-9007
[Article] , (2011)
Note:

SFB 595 C2

Ágoston, Péter and Albe, Karsten and Niemann, Risto M. and Puska, Martti J. :
Intrinsic n-Type Behavior in Transparent Conducting Oxides: A Comparative Hybrid-Functional Study of In_{2}O_{3}, SnO_{2}, and ZnO.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevLett.103.245501]
In: Physical Review Letters, 103 (24) 245501(1-4). ISSN 0031-9007
[Article] , (2009)
Note:

SFB 595 C2

This list was generated on Sun Apr 21 01:08:05 2019 CEST.