Shunjiro Fujii

Scientific CV of Cesare Franchini

Personal information Date of Birth: 03.10.1975, Modena, Italy Nationality: Italian WWW: http://homepage.univie.ac.at/cesare.franchini/ Email: [email protected] Identifier: Researcher ID: B-2084-2009; ORCID ID: orcid.org/0000-0002-7990-2984 Address: Faculty of Physics, University of Vienna, Sensengasse 8, 1090 Vienna, Austria

Research interests Quantum materials modeling in thre and reduced dimensions. Ab initio modeling of materials properties using DFT and beyond DFT (Hybrid functionals, GW, BSE, cRPA) methods for strongly correlated systems, in particular oxides. Combination of ab initio schemes with effective Hamiltonian (tight-binding, spin Hamiltonians, phonon Hamiltonians). First principles molecular dynamics. Correlated collective effects: electron-electron, electron-phonon, spin-orbit, electron-hole; novel quantum states of matter: relativistic insulators and topological insulators; noncollinear spin interactions.

University Education 2002 PhD in physics, Vienna University of Technology 1999 Master in physics, University of Cagliari (Italy)

Career History 2017- Full Professor, Faculty of Physics, University of Vienna 2014-2017 Associate Professor, Faculty of Physics, University of Vienna 2012-2014 Assistant Professor (TT), Faculty of Physics, University of Vienna 2013 Parental Leave 2007-2012 University Assistant, Faculty of Physics, University of Vienna 2004-2007 Postdoc, University of Vienna 2002-2004 Postdoc, University of Cagliari (Italy)

Fellowships and Awards 2016 Shield of Honor, Abbottabad University (Pakistan) 2015 APS Outstanding Referee, American Physical Society 2013 Young International Scientist Fellowship, Chinese Academy of Scienc

Organization of Scientific Meetings (selection) 2017 Intern. Conf. on Strongly Correlated Electron Systems, Prague (Czech Rep.) 2017 Winter School of Magnetism, Vienna 2016 17th Intern. Conf. Of the Asia Materials Sciences, Qingdao (China)

2015 Computational Design and Simulations of Materials, Shenyang (China) 2014 Intern. Conf. of Young Researchers on Advances Materials, Haikou (China)

Professional Activities 2017 Co-Editor Handbook of Materials Modeling Vol. 2, Springer 2017 International advisory committee for China Iron & Steel Research Institute

Publications More 100 peer reviewed publications, h-index=29 (Web of Science), h-index=34 (Google Scholar) 4 in Phys. Rev. Lett., 1 Science, 1 Ang. Chem., 1 JACS., 2 Nat. Comm., 1 PNAS. Number of citations: > 3000 (Web of Science), > 4000 (Google Scholar)

Talks > 50 talks (~20 invited) at conferences and international research institutions. Invited talks (Selection): 1. Collective effects in relativistic oxides, CECAM workshop: Computational methods towards engineering novel correlated materials; Lausanne (Switzerland), October 2016. 2. Hybrid functionals for simulating complex oxides, APS March Meeting Meeting; Baltimora (USA), March 2016. 3. Electronic Structure of Perovskites: Lessons from Hybrid Functionals, Autumn School on Correlated Electrons: Many-Body Physics: From Kondo to Hubbard; Jülich (Germany), September 2015. 4. Small and Large Polarons in TiO2 Rutile and Anatase surfaces, MRS Fall Meeting; Boston (USA), December 2014. 5. Multivalency and polaronic hole trapping in BaBiO3, APS March Meeting; Portland (USA), March 2010.

Mentoring and supervision Supervised 3 master students, 3 PhD students and 6 postdocs Current supervision: 5 master students, 2 PhD students, 2 postdocs

PhD students supervised during the last five years (2013-2018) Name Duration Title Funding Sowmya Murthy 2010-2013 Combined First-Principles and Model FWF Hamiltonian study of RMnO3 (R=La, Pr, Nd, Sm, Eu, Gd) Peitao Liu 2013-2017 Electronic, magnetic and structural properties CAS of the relativistic Ruddlesden-Popper (China)/FWF oxideSr(m+1)IrmO(3m+1) Zeynep Ergönenc 2014-2018 GW for perovskites FWF Michele Reticcioli 2015- Polarons in transition metal oxide surfaces FWF Shafiq Mohammed 2015 Polarons in SrTiO3(100) surface (visiting) HEC Pakistan Shujaat Ali Kahn 2017 VdW heterostructures HEC Pakistan Thomas Hahn 2017- Diagrammatic Monte Carlo FWF

Major International Cooperations of the last five years D. D. Sarma, Indian Institute of Science, Bangalore, India D. Di Sante and Giorgio Sangiovanni , University of Würzburg J. Rondinelli & J. He, Northwestern University X.-Q. Chen, Shenyang National Laboratory for Materials Science, China U. Diebold and Gareth Parkinson, TU Vienna G. Profeta and A. Continenza, University of L'Aquial (Italy) J. Tempere and J. Derveese, University of Antwerpen (Belgium) A. Stroppa and S. Picozzi, CNR Italy G. Profeta and A. Continenza, University of L'Aquila (Italy)

Five selected funded projects

Fund Project Period Total FWF Polarons in Oxides 2016-2019 330.000 €

FWF SFB-ViCoM - Collective Phenomena in Oxide films and 2015-2018 125.000 € Heterostructures

FWF Electron correlation and spin-orbit coupling in 4d and 5d 2014-2017 350.000 € oxides FWF External collaborator of START project “Unravelling Single 2016-2018 110000 € Atom Catalysis: A surface Science Approach”, 2 years Postdoc EU Advanced theories for functional oxides: new routes to handle 2009-2012 350.000 € thedevices of the future

*) In the case of group projects, the amount of funding refers to portion of funds that that went to the group of C. Franchini.

Publications of C. Franchini: Ten selected key publications

1) C. Franchini, V. Bayer, R. Podloucky, J. Paier, and G. Kresse, “Density functional theory study of MnO by an hybrid functional approach” Phys. Rev. B 72, 045132 (2005). DOI:10.1103/PhysRevB.72.045132 [118 citations] 2) C. Franchini, C. Franchini, G. Kresse, and R. Podloucky, “Polaronic hole-trapping in doped BaBiO3”, Phys. Rev. Lett. 102, 256402 (2009). DOI:10.1103/PhysRevLett.102.256402 [53 citations] 3) Z. Wang, Y. Sun, X.-Q. Chen, C. Franchini, G. Xu, H. Weng, X.Dai, and Z. Fang, “Dirac semimetal and topological phases in A 3 Bi (A=Na, K, Rb)”, Phys. Rev. B 85, 195320 (2012). DOI: 10.1103/PhysRevB.85.195320 [576 citations] 4) J. He and Cesare Franchini, “Screened hybrid functional applied to 3d 0 → 3d transition-metal perovskites LaMO3 (M=Sc-Cu): Influence of the exchange mixing parameter on the structural, electronic, and magnetic properties”, Phys. Rev. B 86, 235117 (2012). DOI:10.1103/PhysRevB.86.235117 [64 citations]

5) Z. Wang, Z. Zhong, X. Hao, S. Gerhold, B. Stoeger, M. Schmid, J. Sanchez-Barriga, A. Varykhalov, C. Franchini, K Held, and U. Diebold, “Anisotropic two-dimensional electron gas at SrTiO3(110)”, Proc. Natl. Acad. Sci. 111, 3933 (2014). DOI: 10.1073/pnas.1318304111 [50 citations]

6) M. Setvin, C. Franchini, X. Hao, M. Schmid, A. Janotti, M. Kaltak, C. G. Van de Walle, G. Kresse, and U. Diebold, “Direct view at excess electrons in TiO2 rutile and anatase”, Phys. Rev. Lett. 113, 086402 (2014). DOI:10.1103/PhysRevLett.113.086402 [122 citations]

7) J. He, K. Hummer and C. Franchini, “Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides MoS2, MoSe2, WS2, and WSe2”, Phys. Rev. B 89, 075409 (2014). DOI: 10.1103/PhysRevB.89.075409 [130 citations]

8) P. Liu, S. Khmelevskyi, B. Kim, M. Marsman, D. Li, X-Q Chen, D.D. Sarma, G Kresse, C. Franchini, Anisotropic magnetic couplings and structure-driven canted to collinear transitions in Sr2IrO4 by magnetically constrained noncollinear DFT; Phys. Rev. B 92, 054428 (2015). DOI:10.1103/PhysRevB.92.054428 [20 citations]

9) J. He, D. Di Sante, R. Li, X.-Q. Chen, J.M. Rondinelli, C. Franchini , “Tunable metal-insulator transition, Rashba effect and Weyl Fermions in a relativistic charge-ordered ferroelectric oxide”, Nat. Comm., 9, 492 (2018). DOI: 10.1038/s41457 [0 citations] 10) M. Setvin, M. Reticcioli, F. Poelzleitner, J. Hulva, M. Schmid, L. A. Boatner, C. Franchini, U. Diebold , Polarity compensation mechanisms on a perovskite surface: KtaO3(001), Science 359, 572 (2018). DOI:10.1126/science.aar2287 [0 citations]

Publications 2013-2018 Peer-Reviewed:

1) T. Hahn, S. Klimin, J. Tempere, J. Devreese, and C. Franchini, Diagrammatic Monte Carlo study of the Fröhlich polaron dispersion in two and three dimensions, Phys. Rev. B 97, 134305 (2018). DOI:10.1103/PhysRevB.97.134305

2) Z. Ergonenc, B. Kim, P. Liu, G. Kresse, C. Franchini, Converged GW quasiparticle energies for transition metal oxide perovskites, Phys. Rev. Mat. 2, 024601 (2018). DOI:10.1103/PhysRevMaterials.2.024601

3) M. Setvin, M. Reticcioli, F. Poelzleitner, J. Hulva, M. Schmid, L. A. Boatner, C. Franchini, U. Diebold, Polarity compensation mechanisms on a perovskite surface: KtaO3(001), Science 359, 572 (2018). DOI:10.1126/science.aar2287

4) J. He, D. Di Sante, R. Li, X.-Q. Chen, J.M. Rondinelli, C. Franchini, Tunable metal-insulator transition, Rashba effect and Weyl Fermions in a relativistic charge-ordered ferroelectric oxide, Nature Comm. 9, 492 (2018). DOI:10.1038/s41467-017-02814-4

5) M. Meier, Z. Jakub, J. Balajka, J. Hulva, R. Bliem, P.-K. Thakur, T.-L. Lee, C. Franchini, M. Schmid, U. Diebold, F. Allegretti, D. A. Duncan and G. S. Parkinson , Probing the geometry of copper and silver adatoms on magnetite: quantitative experiment versus theory, Nanoscale 10, 2226 (2018). DOI:10.1103/10.1039/C7NR07319D

6) B. Kim, S. Khmelevskyi, P. Mohn, and C. Franchini, Competing magnetic interactions in spin-1/2 square lattice: hidden order in Sr2VO4, Phys. Rev. B 96, 180405 (2017). DOI:10.1103/PhysRevB.96.180405

7) S. Hu, H. Gao, Y. Qi, Y. Tao, Y. Li, J. Reimers, M. Bokdam, C. Franchini, D. Di Sante, A. Stroppa, W. Ren, Dipole Order in Halide Perovskites: Polarization and Rashba Band Splittings, J. Phys. Chem. C 121, 23045 (2017). DOI:10.1021/acs.jpcc.7b05929

8) M. Reticcioli, M. Setvin, X. Hao, P. Flauger, . Kresse, M. Schmid, U. Diebold, C. Franchini, Polaron-driven surface reconstructions, Phys. Rev. X 7, 031053 (2017). DOI:10.1103/PhysRevX.7.031053

9) Sharada Govinda, Bhushan. P. Kore, Menno Bokdam, Pratibha Mahale, Abhinav Kumar, Somnath Pal, Biswajit Bhattacharyya, Jonathan Lahnsteiner, Georg Kresse, Cesare Franchini, Anshu Pandey and D. D. Sarma, Behavior of methylammonium dipoles in MAPbX3 (X= Br and I), J. Phys. Chem. Lett. 8, 4113 (2017). DOI: 10.1021/acs.jpclett.7b01740

10) J. He and C. Franchini, Assessing the performance of self-consistent hybrid functional for band gap calculation in oxide semiconductors, J. Phys.: Condens. Matter 29, 454004 (2017). DOI:10.1088/1361-648X/aa867e 5

11) Domenico Di Sante, Pranab Kumar Das, C. Bigi, Z. Ergönenc, N. Gürtler, J. A. Krieger, T. Schmitt, M. N. Ali, G. Rossi, R. Thomale, C. Franchini, S. Picozzi, J. Fujii, V. N. Strocov, G. Sangiovanni, I. Vobornik, R. J. Cava, G. Panaccione, Three-Dimensional Electronic Structure of type-II Weyl Semimetal WTe2, Phys. Rev. Lett. 119, 026403 (2017). DOI:10.1103/PhysRevLett.119.026403

12) Bongjae Kim, Sergii Khmelevskyi, Igor Mazin, Daniel Agterberg, Cesare Franchini, Anisotropy of magnetic interactions and symmetry of the order parameter in unconventional superconductor Sr2RuO4, npj Quantum Materials 3, 37 (2017). DOI:10.1038/s41535-017-0041-8

13) Andriy Smolyanyuk, Lilia Boeri, Cesare Franchini, Ab-initio prediction of the high-pressure phase diagram of BaBiO3 , Phys. Rev. B 96, 035103 (2017). DOI:10.1103/PhysRevB.96.035103

14) M. Reticcioli, G. Profeta, C. Franchini, A. Continenza, Ru-doping on iron based pnictides: the "unfolded" dominant role of structural effects for superconductivity, Phys. Rev. B 95 214510 (2017). DOI: 10.1103/PhysRevB.95.214510

15) Bongjae Kim, Peitao Liu, and Cesare Franchini, “Dimensionality-strain phase diagram of strontium iridates”, Phys. Rev. B, 95 11511 (2917). DOI:10.1103/PhysRevB.95.115111

16) Bongjae Kim, Peitao Liu, and Cesare Franchini, “Magnetic properties of bilayer Sr3Ir2O7: role of epitaxial strain and oxygen vacancies”, Phys. Rev. B 95, 024406 (2017). DOI:10.1103/PhysRevB.95.024406

17) Jonathan Lahnsteiner, Georg Kresse, Abhinav Kumar, D.D. Sarma, Cesare Franchini, and Menno Bokdam, “Room Temperature Dynamic Correlation between Methylammonium Molecules in Lead-Iodine Based Perovskites: an Ab-initio Molecular Dynamics Perspective”, Phys. Rev. B 94, 214114 (2016). DOI:10.1103/PhysRevB.94.214114.

18) J. He, C. Franchini, and J. Rondinelli, “Ferroelectric oxides with strong visible-light absorption from charge ordering”, Chem. Mater. (2017). DOI:10.1021/acs.chemmater.6b03486

19) P. Liu, M. Reticcioli, B. Kim, A. Continenza, G. Kresse, D.D. Sarma, X.-Q Chen, C. Franchini, “ Electron and hole doping in the relativistic Mott insulator Sr2IrO4: a first-principles study using band unfolding technique”, Phys. Rev. B 94, 195145 (2016). DOI:10.1103/PhysRevB.94.195145

20) Bongjae Kim, Peitao Liu, Zeynep Ergonenc, Alessandro Toschi, Sergii Khmelevskyi, Cesare Franchini, “Lifshitz transition driven by spin fluctuations and spin-orbit renormalization in NaOsO3”, Phys. Rev. B 94, 241113(R) (2016). doi:10.1103/PhysRevB.94.241113

21) Roman Kovacik, Sowmya Sathyanarayana Murthy, Carmen E. Quiroga, Claude Ederer, Cesare Franchini, “Combined first-principles and model Hamiltonian study of the perovskite series RMnO3 (R = La, Pr, Nd, Sm, Eu and Gd)3 ”, Physical Review B 93, 075139 (2016). DOI:10.1103/PhysRevB.93.075139

22) P. Moses, A. Janotti, C. Franchini, G. Kresse, C. Van de Walle, “Donor defects and small polarons on the TiO2(110) surface ”, J. Appl. Phys. 119, 181503 (2016). DOI: 10.1038/srep28618

23) Menno Bokdam, Tobias Sander, Alessandro Stroppa, Silvia Picozzi, D.D. Sarma, Cesare Franchini, and Georg Kresse, “Role of Polar Phonons in the Photo Excited State of Metal Halide Perovskites ”, Scientific Reports 6, 28618 (2016). DOI: 10.1038/srep28618

24) Hyunji An, Jun young Han, Bongjae Kim, Jaesun Song, Sang Yun Jeong, Cesare Franchini, Chung Wung Bark, “Large enhancement of the photovoltaic effect in ferroelectric complex oxides through bandgap reduction”, Scientific Reports 6, 28313 (2016). DOI: 10.1038/srep28313

25) Jiangang He, Cesare Franchini, and James M. Rondinelli, “Lithium Niobate-type Oxides as Visible Light Absorber Materials”, Chem. Mater., 28, 25–29 (2016). DOI: 10.1021/acs.chemmater.5b03356

26) Michele Reticcioli, Gianni Profeta, Cesare Franchini and Alessandra Continenza, “Effective band structure of Ru-doped BaFe2As2”, J. Phys.: Conf. Ser. 689 012027 (2016). DOI: 10.1088/1742- 6596/689/1/012027

27) Peitao Liu, Sergii Khmelevskyi, Bongjae Kim, Martijn Marsman, Dianzhong Li, Xing-Qiu Chen, D.D. Sarma, Georg Kresse, Cesare Franchini , “Anisotropic magnetic couplings and structure- driven canted to collinear transitions in Sr2IrO4 by magnetically constrained noncollinear DFT”, Phys. Rev. B 92, 054428 (2015). DOI:10.1103/PhysRevB.92.054428

28) Xianfeng Hao, Zhiming Wang, Michael Schmid, Ulrike Diebold, Cesare Franchini, Coexistence of trapped and free excess electrons in SrTiO3, Phys. Rev. B, 91, 085204 (2015). DOI:10.1103/PhysRevB.91.085204

29) X. Hao, Y. Xu, C. Franchini, F. Gao, “Covalent effects in magnetic ferroelectrics MnMO3 (M=Ti,Sn)”, Phys. Status Solidi B 252, 626 (2015). DOI:10.1002/pssb.201451476

30) Peter Amann, Michael Cordin, Thomas Goetsch, Alexander Menzel, Erminald Bertel, Josef Redinger, Cesare Franchini, “Halogen phases on Pd(110): Compression Structures, Domain Walls and Corrosion”, J. Phys. Chem. C 119, 3613 (2015). DOI: 10.1021/jp512268D

31) A. Stroppa, D. Di Sante, P. Barone, M. Bokdam, G. Kresse, C. Franchini, M.-H. Whang, and S. Picozzi, “Tunable ferroelectric polarization and its interplay with spin-orbit coupling in tin iodide perovskites”, Nat. Comm., 5, 5900 (2014). DOI: 10.1038/ncomms6900

32) N. Oberkalmsteiner, M. Cordin, S. Durrbeck, E. Bertel, J. Redinger and C. Franchini, Degenerate phases of Iodine on Pt(110) at half-monolayer coverage, J. Phys. Chem. 118, 29919 (2014). DOI: 10.1021/jp509687b

33) Martin Setvin, Cesare Franchini, Xianfeng Hao, Michael Schmid, Anderson Janotti, Merzuk Kaltak, Chris G. Van de Walle, Georg Kresse, and Ulrike Diebold, “Direct view at excess electrons 7

in TiO2 rutile and anatase”, Phys. Rev. Lett. 113, 086402 (2014). DOI:10.1103/PhysRevLett.113.086402

34) M. Setvin, X. Hao, B. Daniel, J. Pavelec, Z. Novotny, G. S. Parkinson, M. Schmid, G. Kresse, C. Franchini, and U. Diebold, “Charge Trapping at the Step Edges of TiO2 Anatase (101)”, Angew. Chem. Int. Ed. 53, 4714 (2014). DOI: 10.1002/anie.201309796

35) Z. Wang, X. Hao, S. Gerhold, P Mares, M. Wagner, R. Bliem, K. Schulte, M. Schmid, C. Franchini, U. Diebold, “Stabilizing Single Ni adatoms on a Two-dimensional Porous Titania Overlayer at the SrTiO3 (110) Surface”, J. Phys. Chem. 118, 19904 (2014). DOI:10.1021/jp506234r

36) C. Franchini, “Hybrid functionals applied to perovskites”, J. Phys.: Condens. Matter 26, 253202 (2014). DOI: 10.1088/0953-8984/26/25/253202

37) Z. Wang, Z. Zhong, X. Hao, S. Gerhold, B. Stoeger, M. Schmid, J. Sanchez-Barriga, A. Varykhalov, C. Franchini, K Held, and U. Diebold, “Anisotropic two-dimensional electron gas at SrTiO3(110)”, Proc. Natl. Acad. Sci. 111, 3933 (2014). DOI: 10.1073/pnas.1318304111

38) Martin Setvin, Xianfeng Hao, Benjamin Daniel, Jiri Pavelec, Zbynek Novotny, Gareth Parkinson, Michael Schmid, Georg Kresse, Cesare Franchini, and Ulrike Diebold, “Charge Trapping at the Step Edges of TiO2 Anatase (101)”, Angew. Chem. Int. Ed. Engl. 53, 4714 (2014). DOI: 10.1002/anie.201309796

39) Z. Wang, X.Hao, S. Gerhold, M. M. Schmid, C. Franchini, U. Diebold, “Vacancy clusters at domain boundaries and band bending at the SrTiO3 (110) surface”, Phys. Rev. B 90, 035436 (2014). DOI: 10.1103/PhysRevB.90.035436

40) P. Geiger, C. Dellago, M. Macher, C. Franchini, G. Kresse, J. Bernard, T. Loerting, “Proton Ordering of Cubic Ice Ic: Spectroscopy and Computer Simulations”, J. Phys. Chem. C 118, 10989 (2014). DOI: 10.1021/jp500324x

41) Markus Macher, Jiri Klimes, C. Franchini, and Georg Kresse, “The random phase approximation applied to ice”, J. Chem. Phys. 140, 084502 (2014). DOI: 10.1063/1.4865748

42) M. Cordin, B.A.J. Lechner, S. Duerrbeck, A. Menzel, E. Bertel, J. Redinger, and C. Franchini, “Experimental observation of defect pair separation triggering phase transitions”, Scientific Reports 4, 4110 (2014). DOI: 10.1038/srep04110

43) J. He, K. Hummer and C. Franchini, “Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides MoS2, MoSe2, WS2, and WSe2”, Phys. Rev. B 89, 075409 (2014). DOI: 10.1103/PhysRevB.89.075409

44) J. He and C. Franchini, “Structural determination and electronic properties of the 4d perovskite SrPdO3”, Phys. Rev. B 89, 045104 (2014). DOI: 10.1103/PhysRevB.89.045104

45) X. F. Hao, A. Stroppa, P. Barone, A. Filippetti, C. Franchini, S. Picozzi, “Structural and 8

ferroelectric transitions in magnetic nickelate PbNiO3”, New J. Phys. 16 015030 (2014). DOI:10.1088/1367-2630/16/1/015030

46) Y. Sun, Z. Zhong, T. Shirakawa, C. Franchini, D. Li, Y. Li, S. Yunoki, X.-Q. Chen, “Rock-salt SnS and SnSe: Native topological crystalline insulators”, Phys. Rev. B 88, 235122 (2013). DOI: 10.1103/PhysRevB.88.235122

47) Zhiming Wang, Xianfeng Hao, Stefan Gerhold, Zbynek Novotny, C. Franchini, Eamon McDermott, Karina Schulte, Michael Schmid, and Ulrike Diebold, “Water Adsorption at the Tetrahedral Titania Surface Layer of SrTiO3 (110)-(4×1)”, J. Phys. Chem C 117, 26060 (2013). DOI: 10.1021/jp407889h

48) Guangfen Wu, Hua Chen, Yan Sun, Xiaoguang Li Ping Cui, C. Franchini, Jinlan Wang, Xing-Qiu Chen and Zhenyu Zhang,”Tuning the vertical location of helical surface states in topological insulator heterostructures via dual-proximity effects”, Scientific Reports 3, 1233 (2013). DOI: 0.1038/srep01233

49) Yuanhui Xu, Xianfeng Hao, C. Franchini, Faming Gao, “Structural, Electronic, and Ferroelectric Properties of Compressed CdPbO3 Polymorphs”, Inorg. Chem. 52, 10321039 (2013). DOI: 10.1021/ic302298s

50) A. Janotti, C. Franchini, J. Varley, G. Kresse and C. G. Van de Walle, “Dual behavior of excess electrons in rutile TiO2”, Phys. Status Solidi RRL 7, 199 (2013). DOI: 10.1002/pssr.201206464

Non Peer-Reviewed:

51) A.J. Millis, D.D. Sarma, “The driving force for charge ordering in rare earth nickelates”, under review, arXiv: 1701.06819.

52) Ronghan Li, Yuanfeng Xu, Jiangang He, Sami Ullah, Jiangxiu Li, Jun-Ming Liu, Dianzhong Li, Hongming Weng, Cesare Franchini, and Xing-Qiu Chen, “Weyl Ferroelectric semimetals” arXiv: 1610.07142.

53) Michele Riva, Markus Kubicek, Xianfeng Hao, Stefan Gerhold, Giada Franceschi, Michael Schmid, Herbert Hutter, Juergen Fleig, Cesare Franchini, Bilge Yildiz, and Ulrike Diebold, “The Influence of Surface Atomic Structure on Solid State Electrochemistry: Oxygen Exchange on

SrTiO3(110) Surfaces” under review. 54) Matthias Meier, Jan Hulva, Zdenek Jakub, Jrii Pavelec, Martin Setvin, Roland Bliem, Michael Schmid, Ulrike Diebold, Cesare Franchini, and Gareth S. Parkinson, Water Agglomerates on Fe3O4(001), under review. 55) Michele Reticcioli, Martin Setvin, Michael Schmid, Ulrike Diebold, and Cesare Franchini, Formation and dynamics of small polarons on the rutile TiO2(110) surface, under review.

56) P. Ryan, Z. Jakub, J. Balajka, J. Hulva, M. Meier, J. Küchle, P. Blowey, P.K. Thakur, C. Franchini, D. Payne, D. Woodroff, L. Rochford, F. Allegretti, TL Lee, G. Parlinson, D.A. Duncan, Direct

measurement of Ni incorporation into Fe3O4, under review.