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Einträge mit Organisationseinheit "DFG-Sonderforschungsbereiche (inkl. Transregio) > Sonderforschungsbereiche > SFB 595: Elektrische Ermüdung > C - Modellierung"

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A

Agoston, Peter ; 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.
[Artikel], (2011)
Note:

SFB 595 C2

Agoston, Peter ; 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.
[Artikel], (2011)
Note:

SFB 595 C2

Agoston, Peter ; Koerber, Christoph ; Klein, Andreas ; Puska, Martti J. ; Nieminen, Risto M. ; 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
[Artikel], (2010)
Note:

SFB 595 Cooperation C2, D3

Agoston, Peter ; 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
[Artikel], (2010)
Note:

SFB 595 C2

Agoston, Peter ; Erhart, Paul ; Klein, Andreas ; 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
[Artikel], (2009)
Note:

SFB 595 Cooperation C2, D3

Agoston, Peter ; 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.
[Artikel], (2009)
Note:

SFB 595 C2

Albe, Karsten ; Erhart, P. ; 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.
[Artikel], (2007)
Note:

SFB 595 C2

Arkhipov, V. I. ; Emelianova, E. V. ; Schmechel, Roland ; Seggern, Heinz von :
Thermally stimulated luminescence versus thermally stimulated current in organic solids.
[Online-Edition: http://dx.doi.org/10.1016/j.jnoncrysol.2004.03.056]
In: Journal of non-crystalline solids, 338/34 pp. 626-629.
[Artikel], (2004)
Note:

SFB 595 Cooperation C5, D4

Arkhipov, V. I. ; Seggern, Heinz von ; Emelianova, E. V. :
Charge injection versus space-charge-limited current in organic light-emitting diodes.
[Online-Edition: http://dx.doi.org/10.1063/1.1633967]
In: Applied physics letters, 83 (24) pp. 5074-5076.
[Artikel], (2003)
Note:

SFB 595 C5

D

Diehm, P. Manuel ; Ágoston, Péter ; Albe, Karsten :
Size-Dependent Lattice Expansion in Nanoparticles: Reality or Anomaly?
[Online-Edition: http://dx.doi.org/10.1002/cphc.201200257]
In: ChemPhysChem, 13 (10) pp. 2443-2454. ISSN 14394235
[Artikel], (2012)
Note:

SFB 595 C1

Dineva, P. ; Rangelov, T. ; Gross, Dietmar :
BIEM for 2D steady-state problems in cracked anisotropic materials.
[Online-Edition: http://dx.doi.org/10.1016/j.enganabound.2005.02.006]
In: Engineering Analysis with Boundary Elements, 29 (7) pp. 689-698. ISSN 09557997
[Artikel], (2005)
Note:

SFB 595 C3

E

Erhart, Paul ; Albe, Karsten :
Dopants and dopant–vacancy complexes in tetragonal lead titanate: A systematic first principles study.
[Online-Edition: http://dx.doi.org/10.1016/j.commatsci.2015.02.029]
In: Computational Materials Science, 103 pp. 224-230. ISSN 09270256
[Artikel], (2015)

Erhart, Paul ; Träskelin, Petra ; Albe, Karsten :
Formation and switching of defect dipoles in acceptor-doped lead titanate: A kinetic model based on first-principles calculations.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.88.024107]
In: Physical Review B, 88 (2) 024107(1-10). ISSN 1098-0121
[Artikel], (2013)
Note:

SFB 595 C1

Erhart, Paul ; Albe, Karsten :
Modeling the electrical conductivity in BaTiO[sub 3] on the basis of first-principles calculations.
[Online-Edition: http://dx.doi.org/10.1063/1.2956327]
In: Journal of Applied Physics, 104 (4) 044315-1-044315-8. ISSN 00218979
[Artikel], (2008)
Note:

SFB 595 C1

Eichel, Rüdiger-A. ; Erhart, Paul ; Träskelin, Petra ; Albe, Karsten ; Kungl, Hans ; Hoffmann, Michael J. :
Defect-Dipole Formation in Copper-Doped PbTiO3 Ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevLett.100.095504]
In: Physical Review Letters, 100 (9) 095504-1. ISSN 0031-9007
[Artikel], (2008)
Note:

SFB 595 Cooperation A2, B1, C2

Erhart, Paul ; Eichel, Rüdiger-A. ; Träskelin, Petra ; 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.
[Artikel], (2007)
Note:

SFB 595 Cooperation B1, C1, C2

Erhart, Paul ; Albe, Karsten :
Thermodynamics of mono- and di-vacancies in barium titanate.
[Online-Edition: http://dx.doi.org/10.1063/1.2801011]
In: Journal of Applied Physics, 102 (8) 084111-1. ISSN 00218979
[Artikel], (2007)
Note:

SFB 595 C1

Erhart, Paul ; Klein, Andreas ; Egdell, Russell ; 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
[Artikel], (2007)
Note:

SFB 595 Cooperation C2, D3

Erhart, Paul ; Juslin, Niklas ; Goy, Oliver ; Nordlund, Kai ; Müller, Ralf ; 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
[Artikel], (2006)
Note:

SFB 595 Cooperation C2, C3

Erhart, Paul ; Albe, Karsten ; 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
[Artikel], (2006)
Note:

SFB 595 Cooperation C2, D3

Erhart, Paul ; 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
[Artikel], (2006)
Note:

SFB 595 C2

Erhart, Paul ; 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
[Artikel], (2006)
Note:

SFB 595 C2

Erhart, Paul ; Klein, Andreas ; 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
[Artikel], (2005)
Note:

SFB 595 Cooperation C2, D3

G

Genenko, Yuri A. ; Glaum, Julia ; Hoffmann, Michael J. ; Albe, Karsten :
Mechanisms of aging and fatigue in ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1016/j.mseb.2014.10.003]
In: Materials Science and Engineering: B, 192 pp. 52-82. ISSN 09215107
[Artikel], (2015)
Note:

SFB 595 Cooperation C1, C5, D1, T2

Gassmann, Andrea ; Yampolskii, Sergey V. ; Klein, Andreas ; Albe, Karsten ; Vilbrandt, Nicole ; Pekkola, Oili ; Genenko, Yuri A. ; Rehahn, Matthias ; 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
[Artikel], (2015)
Note:

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

Gröting, Melanie ; Albe, Karsten :
Comparative study of A-site order in the lead-free bismuth titanates M1/2Bi1/2TiO3.
[Online-Edition: http://dx.doi.org/10.1016/j.jssc.2014.02.017]
In: Journal of Solid State Chemistry, 213 pp. 138-144. ISSN 00224596
[Artikel], (2014)
Note:

SFB 595 C1

Genenko, Yuri A. ; Hirsch, Ofer ; Erhart, Paul :
Surface potential at a ferroelectric grain due to asymmetric screening of depolarization fields.
[Online-Edition: http://dx.doi.org/10.1063/1.4867984]
In: Journal of Applied Physics, 115 (10) p. 104102. ISSN 0021-8979
[Artikel], (2014)
Note:

SFB 595 C5

Gröting, Melanie ; Albe, Karsten :
Theoretical prediction of morphotropic compositions in Na1/2Bi1/2TiO3-based solid solutions from transition pressures.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.89.054105]
In: Physical Review B, 89 (5) 054105(1-9). ISSN 1098-0121
[Artikel], (2014)
Note:

SFB 595 C1

Genenko, Yuri A. ; Wehner, Jens ; von Seggern, Heinz :
Self-consistent model of polarization switching kinetics in disordered ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1063/1.4818951]
In: Journal of Applied Physics, 114 (8) 084101(1-6). ISSN 00218979
[Artikel], (2013)
Note:

SFB 595 Cooperation B7,C5

Gröting, Melanie ; Kornev, Igor ; Dkhil, Brahim ; Albe, Karsten :
Pressure-induced phase transitions and structure of chemically ordered nanoregions in the lead-free relaxor ferroelectric Na_{1/2}Bi_{1/2}TiO_{3}.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.86.134118]
In: Physical Review B, 86 (13) 134118(1-10). ISSN 1098-0121
[Artikel], (2012)
Note:

SFB 595 C1

Glaum, Julia ; Genenko, Yuri A. ; Kungl, Hans ; Schmitt, Ljubomira A. ; Granzow, Torsten :
De-aging of Fe-doped lead-zirconate-titanate ceramics by electric field cycling: 180°- vs. non-180° domain wall processes.
[Online-Edition: http://dx.doi.org/10.1063/1.4739721]
In: Journal of Applied Physics, 112 (3) 034103(1-9). ISSN 00218979
[Artikel], (2012)
Note:

SFB 595 Cooperation B3, C5, D1, T2

Genenko, Yuri A. ; Zhukov, Sergey ; Yampolskii, Sergey V. ; Schütrumpf, Jörg ; Dittmer, Robert ; Jo, Wook ; Kungl, Hans ; Hoffmann, Michael J. ; von Seggern, Heinz :
Universal Polarization Switching Behavior of Disordered Ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1002/adfm.201102841]
In: Advanced Functional Materials, 22 (11) pp. 2058-2066. ISSN 1616301X
[Artikel], (2012)
Note:

SFB 595 Cooperation A1, B7, C5, D1, T2

Gröting, Melanie ; Hayn, Silke ; Albe, Karsten :
Chemical order and local structure of the lead-free relaxor ferroelectric (Na1/2Bi1/2)TiO3.
[Online-Edition: http://www.sciencedirect.com/science/article/pii/S0022459611...]
In: Journal of Solid State Chemistry, 184 (8) pp. 2041-2046.
[Artikel], (2011)
Note:

SFB 595 C1

Genenko, Yuri A. ; Yampolskii, Sergey V. ; Melzer, Christian ; Stegmaier, Katja ; Seggern, Heinz von :
Charge carrier injection into insulating media: Single-particle versus mean-field approach.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.81.125310]
In: Physical Review B, 81 (12) 125310-1-125310-15. ISSN 1098-0121
[Artikel], (2010)
Note:

SFB 595 Cooperation C5, D4

Genenko, Yuri A. ; Glaum, Julia ; Hirsch, O. ; Kungl, Hans ; Hoffmann, Michael J. ; Granzow, Torsten :
Aging of poled ferroelectric ceramics due to relaxation of random depolarization fields by space-charge accumulation near grain boundaries.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.80.224109]
In: Physical Review B, 80 (224109) pp. 1-9. ISSN 1098-0121
[Artikel], (2009)
Note:

SFB 595 Cooperation A2, C5, D1

Genenko, Yuri A. ; Yampolskii, Sergey V. ; Melzer, Christian ; Seggern, Heinz von :
Self-Consistent Phenomenological Theory of Charge Injection at the Conductor/Insulator Interface.
[Online-Edition: http://dx.doi.org/10.1080/10584580903213225]
In: Integrated Ferroelectrics, 106 (1) pp. 49-60. ISSN 1058-4587
[Artikel], (2009)
Note:

SFB 595 Cooperation C5, D4

Goy, Oliver ; Mueller, Ralf ; Gross, Dietmar :
Configurational forces on point defects in ferroelectric materials.
[Online-Edition: http://dx.doi.org/10.1002/zamm.200800159]
In: ZAMM, 89 (8) pp. 641-650. ISSN 00442267
[Artikel], (2009)
Note:

SFB 595 C3

Goy, Oliver ; Mueller, Ralf ; Gross, Dietmar :
Modelling of point defects in anisotropic media with an application to ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1016/j.commatsci.2008.05.017]
In: Computational Materials Science, 45 (3) pp. 812-815. ISSN 09270256
[Artikel], (2009)
Note:

SFB 595 C3

Genenko, Yuri A. :
Space-charge mechanism of aging in ferroelectrics: An analytically solvable two-dimensional model.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.78.214103]
In: Physical Review B, 78 (21) 214103-1-214103-7. ISSN 1098-0121
[Artikel], (2008)
Note:

SFB 595 C5

Genenko, Yuri A. ; Balke, Nina ; Lupascu, Doru C. :
Migration of Charged Defects in Local Depolarization Fields as a Mechanism of Aging in Ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1080/00150190802381563]
In: Ferroelectrics, 370 (1) pp. 196-202. ISSN 0015-0193
[Artikel], (2008)
Note:

SFB 595 Cooperation C5, D1

Genenko, Yuri A. ; Lupascu, Doru C. :
Erratum: Drift of charged defects in local fields as aging mechanism in ferroelectrics [Phys. Rev. B 75, 184107 (2007)].
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.76.149907]
In: Physical Review B, 76 (14) 149907-1-149907-1. ISSN 1098-0121
[Artikel], (2007)
Note:

SFB 595 Cooperation C5, D1

Genenko, Yuri A. ; Lupascu, Doru C. :
Drift of charged defects in local fields as aging mechanism in ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.75.184107]
In: Physical Review B, 75 (18) pp. 184107-1. ISSN 1098-0121
[Artikel], (2007)
Note:

SFB 595 Cooperation C5, D1

Goy, Oliver ; Müller, Ralf ; Gross, Dietmar :
Interaction of point defects in piezoelectric materials : numerical simulations in the context of electric fatigue.
In: Journal of theoretical and applied mechanics, 44 (4) pp. 819-836.
[Artikel], (2006)
Note:

SFB 595 C3

Gross, Dietmar ; Rangelov, T. ; Dineva, P. :
2DWave Scattering by a Crack in a Piezoelectric Plane Using Traction BIEM.
In: SID, 1 (1) pp. 35-47. ISSN 1551-3750
[Artikel], (2005)
Note:

SFB 595 C3

Gross, Dietmar ; Kolling, Stefan ; Müller, Ralf ; Schmidt, Ingo :
Configurational forces and their application in solid mechanics.
[Online-Edition: http://dx.doi.org/10.1016/S0997-7538(03)00076-7]
In: European Journal of mechanics A : Solids, 22 pp. 669-692.
[Artikel], (2003)
Note:

SFB 595 C3

H

Hausbrand, René ; Cherkashinin, Gennady ; Ehrenberg, Helmut ; Gröting, Melanie ; Albe, Karsten ; Hess, Christian ; Jaegermann, Wolfram :
Fundamental degradation mechanisms of layered oxide Li-ion battery cathode materials: Methodology, insights and novel approaches.
[Online-Edition: http://dx.doi.org/10.1016/j.mseb.2014.11.014]
In: Materials Science and Engineering: B, 192 pp. 3-15. ISSN 09215107
[Artikel], (2015)
Note:

SFB 595 Cooperation A3, B4, B8, C1

J

Juslin, N. ; Erhart, P. ; Traskelin, P. ; Nord, J. ; Henriksson, K. O. E. ; Nordlund, K. ; Salonen, E. ; 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
[Artikel], (2005)
Note:

SFB 595 C2

K

Kling, Jens ; Hayn, Silke ; Schmitt, Ljubomira A. ; Gröting, Melanie ; Kleebe, Hans-Joachim ; Albe, Karsten :
A-site occupancy in the lead-free (Bi[sub 1/2]Na[sub 1/2]TiO[sub 3])[sub 0.94]–(BaTiO[sub 3])[sub 0.06] piezoceramic: Combining first-principles study and TEM.
[Online-Edition: http://dx.doi.org/10.1063/1.3437631]
In: Journal of Applied Physics, 107 (11) p. 114113. ISSN 0021-8979
[Artikel], (2010)
Note:

SFB 595 Cooperation B3, C1

Körber, Christoph ; Ágoston, Péter ; 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
[Artikel], (2009)
Note:

SFB 595 Cooperation C2, D3

Kolling, Stefan ; Müller, Ralf ; Gross, Dietmar :
A computational concept for the kinetics of defects in anisotropic materials.
[Online-Edition: http://atom.me.gatech.edu/zhut/Refer/Mueller/Kolling_CompMat...]
In: Computational Materials Science, 26 pp. 87-94. ISSN 0927-0526
[Artikel], (2003)
Note:

SFB 595 C3

L

Li, Shunyi ; Morasch, Jan ; Klein, Andreas ; Chirila, Christina ; Pintilie, Lucian ; Jia, Lichao ; Ellmer, Klaus ; Naderer, Michael ; Reichmann, Klaus ; Gröting, Melanie ; Albe, Karsten :
Influence of orbital contributions to the valence band alignment of Bi2O3, Fe2O3, BiFeO3, and Bi0.5Na0.5TiO3.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.88.045428]
In: Physical Review B, 88 (4) 045428. ISSN 1098-0121
[Artikel], (2013)
Note:

SFB 595 Cooperation B7, C1

Laubach, Sonja ; Laubach, Stefan ; Schmidt, Peter C. ; Gröting, Melanie ; Albe, Karsten ; Jaegermann, Wolfram ; Wolf, Walter :
Structure, Electronic Structure and Defect Formation Energies of LixCo1-yNiyO2 as a Function of x (0<x<1) and y (y = 0, 0.5, 1).
[Online-Edition: http://dx.doi.org/10.1524/zpch.2009.6082]
In: Zeitschrift für Physikalische Chemie, 223 (10-11) pp. 1327-1340. ISSN 0942-9352
[Artikel], (2009)
Note:

SFB 595 Cooperation A3, C1

Laubach, Sonja ; Laubach, Stefan ; Schmidt, Peter C. ; Ensling, David ; Schmid, Stefan ; Jaegermann, Wolfram ; Thißen, Andreas ; Nikolowski, Kristian ; Ehrenberg, Helmut :
Changes in the crystal and electronic structure of LiCoO2 and LiNiO2 upon Li intercalation and de-intercalation.
[Online-Edition: http://dx.doi.org/10.1039/b901200a]
In: Physical Chemistry Chemical Physics, 11 (17) pp. 3278-3289. ISSN 1463-9076
[Artikel], (2009)
Note:

SFB 595 Cooperation A3, B4, C1

Laubach, Stefan ; Schmidt, Peter C. ; Thißen, Andreas ; Fernandez-Madrigal, Francisco Javier ; Wu, Qi-Hui ; Jaegermann, Wolfram ; Klemm, Matthias ; Horn, Siegfried :
Theoretical and experimental determination of the electronic structure of V2O5, reduced V2O5-x and sodium intercalated NaV2O5.
[Online-Edition: http://dx.doi.org/10.1039/b612489e]
In: Physical Chemistry Chemical Physics, 9 (20) pp. 2564-2576. ISSN 1463-9076
[Artikel], (2007)
Note:

SFB 595 Cooperation A3, C1

Lupascu, Doru C. ; Genenko, Yuri A. ; Balke, Nina :
Aging in Ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1111/j.1551-2916.2005.00663.x]
In: Journal of the American Ceramic Society, 89 (1) pp. 224-229. ISSN 0002-7820
[Artikel], (2006)
Note:

SFB 595 Cooperation B5, C5, D1

Lupascu, Doru C. ; Vedesov, Sergej ; Verdier, Cyril ; Rödel, Jürgen ; Seggern, Heinz von :
Stretched exponential relaxation in perovskite ferroelectrics after cyclic loading.
[Online-Edition: http://dx.doi.org/10.1063/1.1636528]
In: Journal of Applied Physics, 95 (3) pp. 1386-1390. ISSN 00218979
[Artikel], (2004)
Note:

SFB 595 Cooperation B5, C5, D1

M

Melzer, Christian ; Genenko, Yuri A. ; Yampolskii, Sergey V. ; Stegmaier, Katja ; Ottinger, Oliver M. ; Seggern, Heinz von :
Charge-carrier injection and transport in organic light-emitting diodes: Single-particle versus mean-field approach.
[Online-Edition: http://dx.doi.org/10.1117/1.3534762]
In: Journal of Photonics for Energy, 1 (1) 011014-1-011014-9. ISSN 19477988
[Artikel], (2011)
Note:

SFB 595 Cooperation C5,D4

Müller, Ralf ; Xu, Bai-Xiang ; Schrade, David ; Gross, Dietmar :
Modeling of Domain Structure Evolution in Ferroelectric Materials.
[Online-Edition: http://dx.doi.org/10.1007/978-90-481-9887-0_9]
In: IUTAM Bookseries, 24 pp. 89-100. ISSN 1875-3507
[Artikel], (2010)
Note:

SFB 595 C3

Müller, Ralf ; Schröder, Jörg ; Lupascu, Doru C. :
Thermodynamic consistent modelling of defects and microstructures in ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1002/gamm.200890007]
In: GAMM-Mitteilungen, 31 (2) pp. 133-1508. ISSN 09367195
[Artikel], (2008)
Note:

SFB 595 Cooperation B5, C3

Müller, Ralf ; Gross, Dietmar ; Schrade, David ; Xu, Bai-Xiang :
Phase field simulation of domain structures in ferroelectric materials within the context of inhomogeneity evolution.
[Online-Edition: http://dx.doi.org/10.1007/s10704-007-9153-7]
In: International Journal of Fracture, 147 (1-4) pp. 173-180. ISSN 0376-9429
[Artikel], (2007)
Note:

SFB 595 C3

Mehling, V. ; Tsakmakis, C. ; Gross, D. :
Phenomenological model for the macroscopical material behavior of ferroelectric ceramics.
[Online-Edition: http://dx.doi.org/10.1016/j.jmps.2007.03.008]
In: Journal of the Mechanics and Physics of Solids, 55 (10) pp. 2106-2141. ISSN 00225096
[Artikel], (2007)
Note:

SFB 595 C3

Mueller, Michael ; Erhart, Paul ; 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.
[Artikel], (2007)
Note:

SFB 595 C2

Mehling, Volkmar ; Tsakmakis, Charalampos ; Gross, Dietmar :
Thermodynamical modeling of ferroelectric polycrystalline material behavior.
[Online-Edition: http://www.wseas.us/e-library/conferences/2006evia/papers/51...]
In: Proceedings of the 2006 IASME/WSEAS International Conference on Continuum Mechanics, Chalkida, Greece ISSN 1109-2769
[Artikel], (2006)
Note:

SFB 595 C3

Mueller, Ralf ; Gross, Dietmar ; Lupascu, Doru C. :
Driving forces on domain walls in ferroelectric materials and interaction with defects.
[Online-Edition: http://dx.doi.org/10.1016/j.commatsci.2005.02.014]
In: Computational Materials Science, 35 (1) pp. 42-52. ISSN 09270256
[Artikel], (2006)
Note:

SFB 595 Cooperation B5, C3

Meštrić, Hrvoje ; Eichel, Rüdiger-A. ; Koss, T. ; Dinse, Klaus-Peter ; Laubach, Sonja ; Laubach, Stefan ; Schmidt, Peter C. ; Schönau, Kristin A. ; Knapp, Michael ; Ehrenberg, Helmut :
Iron-oxygen vacancy defect centers in PbTiO3 : Newman superposition model analysis and density functional calculations.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.71.134109]
In: Physical Review B, 71 (13) 134109-1-134109-10.
[Artikel], (2005)
Note:

SFB 595 Cooperation B1, B3, B4, C1

N

Nikolaenko, Y. M. ; Kuzovlev, Y. E. ; Medvedev, Y. V. ; Mezin, N. I. ; Fasel, C. ; Gurlo, A. ; Schlicker, L. ; Bayer, T. J. M. ; Genenko, Y. A. :
Macro- and microscopic properties of strontium doped indium oxide.
[Online-Edition: http://dx.doi.org/10.1063/1.4891216]
In: Journal of Applied Physics, 116 (4) 043704. ISSN 0021-8979
[Artikel], (2014)
Note:

SFB 595 Cooperation A4, C5, D3

Neumann, Frederik ; Genenko, Yuri A. ; Melzer, Christian ; Yampolskii, Sergey V. ; Seggern, Heinz von :
Self consistent analytical solution of a problem of charge-carrier injection at a conductor/ insulator interface.
In: Physical Review B, 75 184107 (1-10).
[Artikel], (2007)
Note:

SFB 595 Cooperation C5, D4

Neumann, Frederik ; Genenko, Yuri A. ; Melzer, Christian ; Seggern, Heinz von :
Self-consistent theory of unipolar charge-carrier injection in metal/insulator/metal systems.
In: Journal of Applied Physics, 100 084511 (1-8). ISSN 0021-8979
[Artikel], (2006)
Note:

SFB 595 Cooperation C5, D4

Neumann, Frederik ; Genenko, Yuri A. ; Seggern, Heinz von :
The Einstein relation in systems with trap-controlled transport.
In: Journal of Applied Physics, 99 (1) 013704-1-013704-4.
[Artikel], (2006)
Note:

SFB 595 C5

Neumann, Frederik ; Genenko, Yuri A. ; Schmechel, Roland ; Seggern, Heinz von :
The role of diffusion on SCLC transport in double injection devices.
[Online-Edition: http://www.sciencedirect.com/science/article/pii/S0379677905...]
In: Synthetic metals, 150 (3) pp. 291-296.
[Artikel], (2005)
Note:

SFB 595 Cooperation C5, D4

Nord, J. ; Albe, K. ; Erhart, P. ; 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.
[Artikel], (2003)
Note:

SFB 595 C2

S

Schmitt, Ljubomira Ana ; Schrade, David ; Kungl, Hans ; Xu, Bai-Xiang ; Mueller, Ralf ; Hoffmann, Michael J. ; Kleebe, Hans-Joachim ; Fuess, Hartmut :
Bimodal domain configuration and wedge formation in tetragonal Pb[Zr1−xTix]O3 ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1016/j.commatsci.2013.07.020]
In: Computational Materials Science, 81 pp. 123-132. ISSN 09270256
[Artikel], (2014)
Note:

SFB 595 Cooperation B3, C3, C6, T2

Schütrumpf, Jörg ; Zhukov, Sergey ; Genenko, Yuri A. ; von Seggern, Heinz :
Polarization switching dynamics by inhomogeneous field mechanism in ferroelectric polymers.
[Online-Edition: http://dx.doi.org/10.1088/0022-3727/45/16/165301]
In: Journal of Physics D: Applied Physics, 45 (16) 16530 1--6. ISSN 0022-3727
[Artikel], (2012)
Note:

SFB 595 Cooperation B7, C5

Stegmaier, Katja ; Fleissner, Arne ; Janning, Helga ; Yampolskii, Sergey ; Melzer, Christian ; Seggern, Heinz von :
Influence of electrical fatigue on hole transport in poly(p-phenylenevinylene)-based organic light-emitting diodes.
[Online-Edition: http://dx.doi.org/10.1063/1.3610381]
In: Journal of Applied Physics, 110 (3) 034507-1. ISSN 00218979
[Artikel], (2011)
Note:

SFB 595 Cooperation C5, D4

Schilling, A. ; Byrne, D. ; Catalan, G. ; Webber, Kyle G. ; Genenko, Yuri A. ; Wu, G. S. ; Scott, James F. ; Gregg, J. M. :
Domains in Ferroelectric Nanodots.
[Online-Edition: http://dx.doi.org/10.1021/nl901661a]
In: Nano Letters, 9 (9) pp. 3359-3364. ISSN 1530-6984
[Artikel], (2009)
Note:

SFB 595 C5

Schrade, David ; Xu, Bai-Xiang ; Müller, Ralf ; Gross, Dietmar :
On Phase Field Modeling of Ferroelectrics: Parameter Identification and Verification.
In: ASME 2008 Conference on Smart Materials, Adaptive Structures and Intelligent Systems, October 28–30, 2008, Ellicott City, Maryland, USA. Proceedings of the ASME Conference on Smart Materials, Adaptive Structures and Intelligent Systems
[Konferenz- oder Workshop-Beitrag], (2008)
Note:

SFB 595 C3

Schrade, David ; Müller, Ralf ; Gross, Dietmar ; Utschig, Thomas ; Shur, Vladimir Y. ; Lupascu, Doru C. :
Interaction of domain walls with defects in ferroelectric materials.
[Online-Edition: http://dx.doi.org/10.1016/j.mechmat.2006.04.002]
In: Mechanics of materials, 39 (2) pp. 161-174.
[Artikel], (2007)
Note:

SFB 595 Cooperation B5, C3

Schrade, David ; Müller, Ralf ; Xu, Bai-Xiang ; Gross, Dietmar :
Phasenfeldsimulationen in ferroelektrischen Materialien.
In: Beiträge zur Experimentalphysik, Didaktik und computergestützten Physik / herausgegeben von Stefan Kolling. - Berlin : Logos, 2007. - 404 S. ISBN: 978-3-8325-1530-0. Logos, Berlin
[Buchkapitel], (2007)
Note:

SFB 595 C3

Schrade, David ; Müller, Ralf ; Xu, Bai-Xiang ; Gross, Dietmar :
Domain evolution in ferroelectric materials: a continuum phase field model and finite element implementation.
[Online-Edition: http://dx.doi.org/10.1016/j.cma.2007.05.010]
In: Computer Methods in Applied Mechanics and Engineering, 196 (41-44) pp. 4365-4374. ISSN 00457825
[Artikel], (2007)
Note:

SFB 595 C3

Schrade, David ; Müller, Ralf ; Xu, Bai-Xiang ; Gross, Dietmar :
Domain wall pinning by point defects in ferroelectric materials.
In: Smart Structures/Nondestructive Evaluation for Health Monitoring + Diagnostics <San Diego, USA,2007> ; Proceedings of SPIE (2007), vol. 6526 .
[Konferenz- oder Workshop-Beitrag], (2007)
Note:

SFB 595 C3

Schrade, David ; Xu, Bai-Xiang ; Müller, Ralf ; Gross, Dietmar :
Phase field simulations on the interaction of ferroelectric domains with point defects.
In: Proc. Appl. Math. Mech., 7 (1) ISSN 16177061
[Artikel], (2007)
Note:

SFB 595 C3

Schröder, Jörg ; Gross, Dietmar :
Invariant formulation of the electromechanical enthalpy function of transversely isotropic piezoelectric materials.
[Online-Edition: http://dx.doi.org/10.1007/s00419-003-0294-5]
In: Archive of Applied Mechanics (Ingenieur Archiv), 73 (8) pp. 533-552. ISSN 0939-1533
[Artikel], (2004)
Note:

SFB 595 C3

V

Verdier, Cyril ; Lupascu, Doru C. ; Seggern, Heinz von ; Rödel, Jürgen :
Effect of thermal annealing on switching dynamics of fatigued bulk lead zirconate titanate.
[Online-Edition: http://dx.doi.org/10.1063/1.1801679]
In: Applied Physics Letters, 85 (15) pp. 3211-3213. ISSN 00036951
[Artikel], (2004)
Note:

SFB 595 Cooperation C5, D1

X

Xu, Bai-Xiang ; von Seggern, Heinz ; Zhukov, Sergey ; Gross, Dietmar :
An internal-variable-based interface model for the charging process of ferroelectrets.
In: European Journal of Mechanics - A/Solids, 48 pp. 97-111.
[Artikel], (2014)
Note:

SFB 595 Cooperation C6, B7 Frontiers in Finite-Deformation Electromechanics

Xu, Bai-Xiang ; von Seggern, Heinz ; Zhukov, Sergey ; Gross, Dietmar :
Continuum modeling of charging process and piezoelectricity of ferroelectrets.
[Online-Edition: http://dx.doi.org/10.1063/1.4819441]
In: Journal of Applied Physics, 114 (9) 094103(1-12). ISSN 00218979
[Artikel], (2013)
Note:

SFB 595 Cooporation B7, C6

Xu, Bai-Xiang ; Schrade, David ; Gross, Dietmar ; Mueller, Ralf :
Fracture simulation of ferroelectrics based on the phase field continuum and a damage variable.
[Online-Edition: http://dx.doi.org/10.1007/s10704-010-9520-7]
In: International Journal of Fracture, 166 (1-2) pp. 163-172. ISSN 0376-9429
[Artikel], (2010)
Note:

SFB 595 C3

Xu, Bai-Xiang ; Schrade, David ; Gross, Dietmar ; Mueller, Ralf :
Phase field simulation of domain structures in cracked ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1007/s10704-010-9471-z]
In: International Journal of Fracture, 165 (2) pp. 163-173. ISSN 0376-9429
[Artikel], (2010)
Note:

SFB 595 C3

Xu, Bai-Xiang ; Schrade, David ; Müller, Ralf ; Gross, Dietmar ; Granzow, Torsten ; Rödel, Jürgen :
Phase field simulation and experimental investigation of the electro-mechanical behavior of ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1002/zamm.200900344]
In: ZAMM - Journal of Applied Mathematics and Mechanics / Zeitschrift für Angewandte Mathematik und Mechanik, 90 (7-8) pp. 623-632. ISSN 00442267
[Artikel], (2010)
Note:

SFB 595 Cooperation C3, D1

Xu, Bai-Xiang ; Schrade, David ; Mueller, Ralf ; Gross, Dietmar :
Micromechanical analysis of ferroelectric structures by a phase field method.
[Online-Edition: http://dx.doi.org/10.1016/j.commatsci.2008.07.010]
In: Computational Materials Science, 45 (3) pp. 832-836. ISSN 09270256
[Artikel], (2009)
Note:

SFB 595 C3

Xu, Bai-Xiang ; Müller, Ralf ; Schrade, David ; Gross, Dietmar :
Simulation of domain structures in cracked ferroelectric materials.
In: Proc. Appl. Math. Mech., 9 pp. 193-194.
[Artikel], (2009)
Note:

SFB 595 C3

Y

Yampolskii, Sergey V. ; Genenko, Yuri A. ; Melzer, Christian ; Seggern, Heinz von :
Self-consistent model of unipolar transport in organic semiconductor diodes: Accounting for a realistic density-of-states distribution.
[Online-Edition: http://dx.doi.org/10.1063/1.3569839]
In: Journal of Applied Physics, 109 (7) 073722-1. ISSN 00218979
[Artikel], (2011)
Note:

SFB 595 Cooperation C5, D4

Yampolskii, Sergey V. ; Genenko, Yuri A. ; Melzer, Christian ; Stegmaier, Katja ; Seggern, Heinz von :
Bipolar charge-carrier injection in semiconductor/insulator/conductor heterostructures: Self-consistent consideration.
[Online-Edition: http://dx.doi.org/10.1063/1.2990051]
In: Journal of Applied Physics, 104 (7) 073719-1-073719-13. ISSN 00218979
[Artikel], (2008)
Note:

SFB 595 Cooperation C5, D4

Z

Zuo, Yinan ; Genenko, Yuri A. ; Xu, Bai-Xiang :
Charge compensation of head-to-head and tail-to-tail domain walls in barium titanate and its influence on conductivity.
[Online-Edition: http://dx.doi.org/10.1063/1.4891259]
In: Journal of Applied Physics, 116 (4) 044109(1-6). ISSN 0021-8979
[Artikel], (2014)
Note:

SFB 595 Cooperation C5, C6

Zuo, Yinan ; Genenko, Yuri A. ; Klein, Andreas ; Stein, Peter ; Xu, Bai-Xiang :
Domain wall stability in ferroelectrics with space charges.
[Online-Edition: http://dx.doi.org/10.1063/1.4866359]
In: Journal of Applied Physics, 115 (8) 084110. ISSN 0021-8979
[Artikel], (2014)
Note:

SFB 595 Cooperation B7, C5, C6

Zhukov, Sergey ; Kungl, Hans ; Genenko, Yuri A. ; von Seggern, Heinz :
Statistical electric field and switching time distributions in PZT 1Nb2Sr ceramics: Crystal- and microstructure effects.
[Online-Edition: http://dx.doi.org/10.1063/1.4860335]
In: Journal of Applied Physics, 115 (1) 014103(1-13). ISSN 00218979
[Artikel], (2014)
Note:

SFB 595 Cooperation B7, C5, T2

Zhukov, Sergey ; Genenko, Yuri A. ; Acosta, Matias ; Humburg, Heide ; Jo, Wook ; Rödel, Jürgen ; von Seggern, Heinz :
Polarization dynamics across the morphotropic phase boundary in Ba(Zr0.2Ti0.8)O3-x(Ba0.7Ca0.3)TiO3 ferroelectrics.
[Online-Edition: http://dx.doi.org/10.1063/1.4824730]
In: Applied Physics Letters, 103 (15) 152904(1-5). ISSN 00036951
[Artikel], (2013)
Note:

SFB 595 Cooperation A1, B7, C5

Zhukov, Sergey ; Fedosov, Sergey ; Glaum, Julia ; Granzow, Torsten ; Genenko, Yuri A. ; Seggern, Heinz von :
Effect of bipolar electric fatigue on polarization switching in lead-zirconate-titanate ceramics.
[Online-Edition: http://dx.doi.org/10.1063/1.3452326]
In: Journal of Applied Physics, 108 (1) 014105-1. ISSN 00218979
[Artikel], (2010)
Note:

SFB 595 Cooperation B7, C5, D1

Zhukov, Sergey ; Genenko, Yuri A. ; Hirsch, Ofer ; Glaum, Julia ; Granzow, Torsten ; Seggern, Heinz von :
Dynamics of polarization reversal in virgin and fatigued ferroelectric ceramics by inhomogeneous field mechanism.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevB.82.014109]
In: Physical Review B, 82 (1) 014109-1. ISSN 1098-0121
[Artikel], (2010)
Note:

SFB 595 Cooperation B7, C5, D1

Zhukov, Sergey ; Genenko, Yuri A. ; Seggern, Heinz von :
Experimental and theoretical investigation on polarization reversal in unfatigued lead-zirconate-titanate ceramic.
[Online-Edition: http://dx.doi.org/10.1063/1.3380844]
In: Journal of Applied Physics, 108 (1) 014106-1-014106-6. ISSN 00218979
[Artikel], (2010)
Note:

SFB 595 Cooperation B7,C5

Á

Ágoston, Péter ; Albe, Karsten ; Nieminen, Risto M. ; 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
[Artikel], (2011)
Note:

SFB 595 C2

Ágoston, Péter ; Albe, Karsten ; Niemann, Risto M. ; 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
[Artikel], (2009)
Note:

SFB 595 C2

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