| Year |
Citation |
Score |
| 2023 |
Ricca C, Blandenier T, Werner V, Wang X, Pokrant S, Aschauer U. Conversion of LaTiO to LaTiON ammonolysis: a first-principles investigation. Physical Chemistry Chemical Physics : Pccp. PMID 37475639 DOI: 10.1039/d3cp02159a |
0.303 |
|
| 2022 |
De Luca G, Spring J, Kaviani M, Jöhr S, Campanini M, Zakharova A, Guillemard C, Herrero-Martin J, Erni R, Piamonteze C, Rossell MD, Aschauer U, Gibert M. Top-Layer Engineering Reshapes Charge Transfer at Polar Oxide Interfaces. Advanced Materials (Deerfield Beach, Fla.). e2203071. PMID 35841137 DOI: 10.1002/adma.202203071 |
0.77 |
|
| 2022 |
Goesten MG, Xia Y, Aschauer U, Amsler M. Conformational Gap Control in CsTaS. Journal of the American Chemical Society. PMID 35174711 DOI: 10.1021/jacs.1c10947 |
0.74 |
|
| 2022 |
Kaviani M, Aschauer U. Surface and interface effects in oxygen-deficient SrMnO thin films grown on SrTiO. Physical Chemistry Chemical Physics : Pccp. 24: 3951-3957. PMID 35099494 DOI: 10.1039/d1cp04998d |
0.789 |
|
| 2021 |
Liu Y, Bouri M, Yao L, Xia M, Mensi M, Grätzel M, Sivula K, Aschauer U, Guijarro N. Identifying Reactive Sites and Surface Traps in Chalcopyrite Photocathodes. Angewandte Chemie (International Ed. in English). PMID 34428331 DOI: 10.1002/anie.202108994 |
0.694 |
|
| 2021 |
Deng S, Li J, Småbråten DR, Shen S, Wang W, Zhao J, Tao J, Aschauer U, Chen J, Zhu Y, Zhu J. Critical Role of Sc Substitution in Modulating Ferroelectricity in Multiferroic LuFeO. Nano Letters. PMID 34283627 DOI: 10.1021/acs.nanolett.1c02123 |
0.768 |
|
| 2021 |
Bouri M, Ninova S, Ouhbi H, Vonrüti N, Aschauer U. Surface Chemistry of Perovskite Oxynitride Photocatalysts: A Computational Perspective. Chimia. 75: 202-207. PMID 33766203 DOI: 10.2533/chimia.2021.202 |
0.735 |
|
| 2021 |
Pawlak R, Liu X, Ninova S, D'astolfo P, Drechsel C, Liu JC, Häner R, Decurtins S, Aschauer U, Liu SX, Meyer E. On-Surface Synthesis of Nitrogen-Doped Kagome Graphene. Angewandte Chemie (International Ed. in English). PMID 33507589 DOI: 10.1002/anie.202016469 |
0.74 |
|
| 2021 |
Pawlak R, Liu X, Ninova S, D'Astolfo P, Drechsel C, Liu J, Häner R, Decurtins S, Aschauer U, Liu S, Meyer E. Frontispiece: On‐Surface Synthesis of Nitrogen‐Doped Kagome Graphene Angewandte Chemie International Edition. 60. DOI: 10.1002/ANIE.202181561 |
0.697 |
|
| 2020 |
Primasová H, Ninova S, de Capitani M, Daepp J, Aschauer U, Furrer J. Dinuclear thiolato-bridged arene ruthenium complexes: from reaction conditions and mechanism to synthesis of new complexes. Rsc Advances. 10: 40106-40116. PMID 35520857 DOI: 10.1039/d0ra08146a |
0.712 |
|
| 2020 |
Primasová H, Ninova S, de Capitani M, Daepp J, Aschauer U, Furrer J. Dinuclear thiolato-bridged arene ruthenium complexes: from reaction conditions and mechanism to synthesis of new complexes. Rsc Advances. 10: 40106-40116. PMID 35520857 DOI: 10.1039/d0ra08146a |
0.712 |
|
| 2020 |
Ninova S, Strach M, Buonsanti R, Aschauer U. Suitability of Cu-substituted β-MnVO and Mn-substituted β-CuVO for photocatalytic water-splitting. The Journal of Chemical Physics. 153: 084704. PMID 32872886 DOI: 10.1063/5.0019306 |
0.735 |
|
| 2020 |
Pawlak R, Liu X, Ninova S, d'Astolfo P, Drechsel C, Sangtarash S, Häner R, Decurtins S, Sadeghi H, Lambert CJ, Aschauer U, Liu SX, Meyer E. Bottom-up Synthesis of Nitrogen-doped Porous Graphene Nanoribbons. Journal of the American Chemical Society. PMID 32589029 DOI: 10.1021/Jacs.0C03946 |
0.736 |
|
| 2020 |
Vonrüti N, Aschauer U. Catalysis on oxidized ferroelectric surfaces-Epitaxially strained LaTiON and BaTiO for photocatalytic water splitting. The Journal of Chemical Physics. 152: 024701. PMID 31941304 DOI: 10.1063/1.5135751 |
0.798 |
|
| 2020 |
Ricca C, Timrov I, Cococcioni M, Marzari N, Aschauer U. Self-consistent DFT+U+V study of oxygen vacancies in SrTiO3 Arxiv: Materials Science. 2: 23313. DOI: 10.1103/Physrevresearch.2.023313 |
0.356 |
|
| 2020 |
Ninova S, Pokrant S, Aschauer U. Surface Orientation and Structure of LaTiO2N Nanoparticles Acs Applied Energy Materials. 3: 5867-5873. DOI: 10.1021/acsaem.0c00777 |
0.726 |
|
| 2020 |
Bouri M, Aschauer U. Suitability of Different Sr2TaO3N Surface Orientations for Photocatalytic Water Oxidation Chemistry of Materials. 32: 75-84. DOI: 10.1021/Acs.Chemmater.9B02294 |
0.763 |
|
| 2019 |
Vonrüti N, Aschauer U. The role of metastability in enhancing water-oxidation activity. Physical Chemistry Chemical Physics : Pccp. 21: 24354-24360. PMID 31641703 DOI: 10.1039/C9Cp04859F |
0.777 |
|
| 2019 |
Hussain H, Ahmed MHM, Torrelles X, Grinter DC, Cabailh G, Bikondoa O, Nicklin C, Aschauer U, Lindsay R, Thornton G. Water-Induced Reversal of the TiO(011)-(2 × 1) Surface Reconstruction: Observed with in Situ Surface X-ray Diffraction. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 123: 13545-13550. PMID 31205578 DOI: 10.1021/acs.jpcc.9b04383 |
0.322 |
|
| 2019 |
Bizzotto F, Ouhbi H, Fu Y, Wiberg G, Aschauer U, Arenz M. Examining the structure sensitivity of the Oxygen Evolution Reaction on Pt single crystal electrodes: a combined experimental and theoretical study. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 30938896 DOI: 10.1002/cphc.201900193 |
0.784 |
|
| 2019 |
Aschauer U, Vonrüti N, Spaldin NA. Strain-induced heteronuclear charge disproportionation in
EuMnO3 Physical Review Materials. 3. DOI: 10.1103/Physrevmaterials.3.013601 |
0.518 |
|
| 2019 |
Ramirez MO, Lummen TTA, Carrasco I, Barnes E, Aschauer U, Stefanska D, Sen Gupta A, de las Heras C, Akamatsu H, Holt M, Molina P, Barnes A, Haislmaier RC, Deren PJ, Prieto C, et al. Emergent room temperature polar phase in CaTiO3 nanoparticles and single crystals Apl Materials. 7: 011103. DOI: 10.1063/1.5078706 |
0.542 |
|
| 2019 |
Porer M, Fechner M, Bothschafter EM, Rettig L, Narayan A, Radovic M, Savoini M, Esposito V, Rittmann J, Kubli M, Kubacka T, Huber T, Neugebauer M, Abreu E, Grübel S, ... ... Aschauer U, et al. Optically induced transient enhancement of a structural order parameter Epj Web of Conferences. 205: 07001. DOI: 10.1051/EPJCONF/201920507001 |
0.465 |
|
| 2019 |
Ouhbi H, Aschauer U. Water oxidation catalysis on reconstructed NaTaO3 (001) surfaces Journal of Materials Chemistry A. 7: 16770-16776. DOI: 10.1039/C9TA04001C |
0.798 |
|
| 2019 |
Ninova S, Aschauer U. Anion-order driven polar interfaces at LaTiO2N surfaces Journal of Materials Chemistry A. 7: 2129-2134. DOI: 10.1039/C8TA10230A |
0.752 |
|
| 2019 |
Ouhbi H, Aschauer U. Nitrogen Loss and Oxygen Evolution Reaction Activity of Perovskite Oxynitrides Acs Materials Letters. 1: 52-57. DOI: 10.1021/ACSMATERIALSLETT.9B00088 |
0.764 |
|
| 2018 |
Vonrüti N, Aschauer U. Anion Order and Spontaneous Polarization in LaTiO_{2}N Oxynitride Thin Films. Physical Review Letters. 120: 046001. PMID 29437439 DOI: 10.1103/PhysRevLett.120.046001 |
0.773 |
|
| 2018 |
Bouri M, Aschauer U. Bulk and surface properties of the Ruddlesden-Popper oxynitride SrTaON. Physical Chemistry Chemical Physics : Pccp. 20: 2771-2776. PMID 29322129 DOI: 10.1039/c7cp06791g |
0.74 |
|
| 2018 |
YazdanYar A, Aschauer UJ, Bowen P. Adsorption Free Energy of Single Amino Acids at the Rutile (110)/Water Interface Studied by Well-Tempered Metadynamics Journal of Physical Chemistry C. 122: 11355-11363. DOI: 10.1021/Acs.Jpcc.7B12614 |
0.463 |
|
| 2018 |
Mantella V, Ninova S, Saris S, Loiudice A, Aschauer U, Buonsanti R. Synthesis and Size-Dependent Optical Properties of Intermediate Band Gap Cu3VS4 Nanocrystals Chemistry of Materials. 31: 532-540. DOI: 10.1021/ACS.CHEMMATER.8B04610 |
0.71 |
|
| 2018 |
Ouhbi H, Aschauer U. Water oxidation chemistry of oxynitrides and oxides: Comparing NaTaO3 and SrTaO2N Surface Science. 677: 258-263. DOI: 10.1016/j.susc.2018.07.013 |
0.76 |
|
| 2017 |
Balajka J, Aschauer U, Mertens SFL, Selloni A, Schmid M, Diebold U. Surface Structure of TiO2 Rutile (011) Exposed to Liquid Water. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 121: 26424-26431. PMID 29285204 DOI: 10.1021/Acs.Jpcc.7B09674 |
0.524 |
|
| 2017 |
YazdanYar A, Aschauer U, Bowen P. Interaction of biologically relevant ions and organic molecules with titanium oxide (rutile) surfaces: A review on molecular dynamics studies. Colloids and Surfaces. B, Biointerfaces. 161: 563-577. PMID 29149762 DOI: 10.1016/J.Colsurfb.2017.11.004 |
0.511 |
|
| 2017 |
Chandrasena RU, Yang W, Lei Q, Delgado-Jaime MU, Wijesekara KD, Golalikhani M, Davidson B, Arenholz E, Kobayashi K, Kobata M, de Groot FM, Aschauer U, Spaldin NA, Xi X, Gray AX. Strain-engineered oxygen vacancies in CaMnO3 thin films. Nano Letters. PMID 28103040 DOI: 10.1021/Acs.Nanolett.6B03986 |
0.544 |
|
| 2017 |
Ninova S, Aschauer U. Surface structure and anion order of the oxynitride LaTiO2N Journal of Materials Chemistry A. 5: 11040-11046. DOI: 10.1039/C7TA01873H |
0.763 |
|
| 2017 |
Pichler M, Si W, Haydous F, Téllez H, Druce JWR, Fabbri E, Kazzi ME, Döbeli M, Ninova S, Aschauer U, Wokaun A, Pergolesi D, Lippert T. LaTiOxNy Thin Film Model Systems for Photocatalytic Water Splitting: Physicochemical Evolution of the Solid–Liquid Interface and the Role of the Crystallographic Orientation Advanced Functional Materials. 27: 1605690. DOI: 10.1002/Adfm.201605690 |
0.783 |
|
| 2016 |
Edge JM, Kedem Y, Aschauer U, Spaldin NA, Balatsky AV. Erratum: Quantum Critical Origin of the Superconducting Dome in SrTiO_{3} [Phys. Rev. Lett. 115, 247002 (2015)]. Physical Review Letters. 117: 219901. PMID 27911523 DOI: 10.1103/Physrevlett.117.219901 |
0.485 |
|
| 2016 |
Setvin M, Aschauer U, Hulva J, Simschitz T, Daniel B, Schmid M, Selloni A, Diebold U. Following the Reduction of Oxygen on TiO2 Anatase (101) Step by Step. Journal of the American Chemical Society. PMID 27374609 DOI: 10.1021/Jacs.6B04004 |
0.534 |
|
| 2016 |
Marthinsen A, Faber C, Aschauer U, Spaldin NA, Selbach SM. Coupling and competition between ferroelectricity, magnetism, strain, and oxygen vacancies in AMnO3 perovskites Mrs Communications. 6: 182-191. DOI: 10.1557/Mrc.2016.30 |
0.481 |
|
| 2016 |
Aschauer U, Braddell R, Brechbühl SA, Derlet PM, Spaldin NA. Strain-induced structural instability in FeRh Physical Review B. 94. DOI: 10.1103/Physrevb.94.014109 |
0.5 |
|
| 2016 |
Olsen GH, Aschauer U, Spaldin NA, Selbach SM, Grande T. Origin of ferroelectric polarization in tetragonal tungsten-bronze-type oxides Physical Review B. 93. DOI: 10.1103/Physrevb.93.180101 |
0.498 |
|
| 2016 |
Aschauer U, Spaldin NA. Interplay between strain, defect charge state, and functionality in complex oxides Applied Physics Letters. 109: 031901. DOI: 10.1063/1.4958716 |
0.525 |
|
| 2015 |
Edge JM, Kedem Y, Aschauer U, Spaldin NA, Balatsky AV. Quantum Critical Origin of the Superconducting Dome in SrTiO_{3}. Physical Review Letters. 115: 247002. PMID 26705650 DOI: 10.1103/Physrevlett.115.247002 |
0.481 |
|
| 2015 |
Aschauer U, Selloni A. Adsorption of biomedical coating molecules, amino acids, and short peptides on magnetite (110). The Journal of Chemical Physics. 143: 044705. PMID 26233155 DOI: 10.1063/1.4927327 |
0.464 |
|
| 2015 |
Becher C, Maurel L, Aschauer U, Lilienblum M, Magén C, Meier D, Langenberg E, Trassin M, Blasco J, Krug IP, Algarabel PA, Spaldin NA, Pardo JA, Fiebig M. Strain-induced coupling of electrical polarization and structural defects in SrMnO3 films. Nature Nanotechnology. PMID 26030653 DOI: 10.1038/Nnano.2015.108 |
0.535 |
|
| 2015 |
Lee Y, Liu ZQ, Heron JT, Clarkson JD, Hong J, Ko C, Biegalski MD, Aschauer U, Hsu SL, Nowakowski ME, Wu J, Christen HM, Salahuddin S, Bokor JB, Spaldin NA, et al. Large resistivity modulation in mixed-phase metallic systems. Nature Communications. 6: 5959. PMID 25564764 DOI: 10.1038/Ncomms6959 |
0.527 |
|
| 2015 |
Aschauer U, Vonrüti N, Spaldin NA. Effect of epitaxial strain on cation and anion vacancy formation in MnO Physical Review B. 92. DOI: 10.1103/Physrevb.92.054103 |
0.507 |
|
| 2015 |
Aschauer UJ, Tilocca A, Selloni A. Ab initio simulations of the structure of thin water layers on defective anatase TiO2(101) surfaces International Journal of Quantum Chemistry. 115: 1250-1257. DOI: 10.1002/Qua.24918 |
0.506 |
|
| 2014 |
Setvin M, Daniel B, Aschauer U, Hou W, Li YF, Schmid M, Selloni A, Diebold U. Identification of adsorbed molecules via STM tip manipulation: CO, H₂O, and O₂ on TiO₂ anatase (101). Physical Chemistry Chemical Physics : Pccp. 16: 21524-30. PMID 25186563 DOI: 10.1039/C4Cp03212H |
0.667 |
|
| 2014 |
Li YF, Aschauer U, Chen J, Selloni A. Adsorption and reactions of O2 on anatase TiO2. Accounts of Chemical Research. 47: 3361-8. PMID 24742024 DOI: 10.1021/Ar400312T |
0.635 |
|
| 2014 |
Aschauer U, Spaldin NA. Competition and cooperation between antiferrodistortive and ferroelectric instabilities in the model perovskite SrTiO3. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 26: 122203. PMID 24594645 DOI: 10.1088/0953-8984/26/12/122203 |
0.486 |
|
| 2014 |
Tewari A, Aschauer U, Bowen P. Atomistic modeling of effect of Mg on oxygen vacancy diffusion in α-alumina Journal of the American Ceramic Society. 97: 2596-2601. DOI: 10.1111/Jace.13008 |
0.456 |
|
| 2013 |
Setvín M, Aschauer U, Scheiber P, Li YF, Hou W, Schmid M, Selloni A, Diebold U. Reaction of O2 with subsurface oxygen vacancies on TiO2 anatase (101). Science (New York, N.Y.). 341: 988-91. PMID 23990556 DOI: 10.1126/Science.1239879 |
0.68 |
|
| 2013 |
Aschauer U, Pfenninger R, Selbach SM, Grande T, Spaldin NA. Strain-controlled oxygen vacancy formation and ordering in CaMnO3 Physical Review B. 88. DOI: 10.1103/Physrevb.88.054111 |
0.524 |
|
| 2012 |
Scheiber P, Fidler M, Dulub O, Schmid M, Diebold U, Hou W, Aschauer U, Selloni A. (Sub)surface mobility of oxygen vacancies at the TiO2 anatase (101) surface. Physical Review Letters. 109: 136103. PMID 23030108 DOI: 10.1103/Physrevlett.109.136103 |
0.662 |
|
| 2012 |
Aschauer U, Selloni A. Hydrogen interaction with the anatase TiO2(101) surface. Physical Chemistry Chemical Physics : Pccp. 14: 16595-602. PMID 22930163 DOI: 10.1039/C2Cp42288C |
0.498 |
|
| 2012 |
Palacios M, Bowen P, Kappl M, Butt HJ, Stuer M, Pecharromán C, Aschauer UJ, Puertas F. Repulsion forces of superplasticizers on ground granulated blast furnace slag in alkaline media, from AFM measurements to rheological properties Materiales De Construccion. 62: 489-513. DOI: 10.3989/Mc.2012.01612 |
0.433 |
|
| 2012 |
Scheiber P, Fidler M, Dulub O, Schmid M, Diebold U, Hou W, Aschauer U, Selloni A. (Sub)Surface mobility of oxygen vacancies at the TiO 2 anatase (101) surface Physical Review Letters. 109. DOI: 10.1103/PhysRevLett.109.136103 |
0.678 |
|
| 2011 |
Aschauer U, Selloni A. Structure of the rutile TiO2(011) surface in an aqueous environment. Physical Review Letters. 106: 166102. PMID 21599389 DOI: 10.1103/Physrevlett.106.166102 |
0.541 |
|
| 2011 |
Aschauer UJ, Burgos-Montes O, Moreno R, Bowen P. Hamaker 2: A Toolkit for the Calculation of Particle Interactions and Suspension Stability and its Application to Mullite Synthesis by Colloidal Methods Journal of Dispersion Science and Technology. 32: 470-479. DOI: 10.1080/01932691003756738 |
0.419 |
|
| 2011 |
Galmarini S, Aschauer UJ, Tewari A, Aman Y, Gestel CV, Bowen P. Atomistic modeling of dopant segregation in α-alumina ceramics: Coverage dependent energy of segregation and nominal dopant solubility Journal of the European Ceramic Society. 31: 2839-2852. DOI: 10.1016/J.Jeurceramsoc.2011.07.010 |
0.446 |
|
| 2010 |
Aschauer U, Chen J, Selloni A. Peroxide and superoxide states of adsorbed O(2) on anatase TiO(2) (101) with subsurface defects. Physical Chemistry Chemical Physics : Pccp. 12: 12956-60. PMID 20820549 DOI: 10.1039/C0Cp00116C |
0.523 |
|
| 2010 |
Aschauer U, Spagnoli D, Bowen P, Parker SC. Growth modification of seeded calcite using carboxylic acids: atomistic simulations. Journal of Colloid and Interface Science. 346: 226-31. PMID 20304410 DOI: 10.1016/J.Jcis.2010.02.057 |
0.462 |
|
| 2010 |
Aschauer U, Selloni A. Influence of subsurface Ti interstitials on the reactivity of anatase (101) Proceedings of Spie - the International Society For Optical Engineering. 7758. DOI: 10.1117/12.862241 |
0.503 |
|
| 2010 |
Aschauer UJ, Bowen P. Theoretical Assessment of Nd:YAG Ceramic Laser Performance by Microstructural and Optical Modeling Journal of the American Ceramic Society. 93: 814-820. DOI: 10.1111/J.1551-2916.2009.03475.X |
0.399 |
|
| 2010 |
Aschauer U, He Y, Cheng H, Li SC, Diebold U, Selloni A. Influence of subsurface defects on the surface reactivity of TiO 2: Water on anatase (101) Journal of Physical Chemistry C. 114: 1278-1284. DOI: 10.1021/Jp910492B |
0.525 |
|
| 2010 |
Aschauer U, Ebert J, Aimable A, Bowen P. Growth modification of seeded calcite by carboxylic acid oligomers and polymers: Toward an understanding of complex growth mechanisms Crystal Growth and Design. 10: 3956-3963. DOI: 10.1021/Cg1005105 |
0.43 |
|
| 2010 |
Stuer M, Zhao Z, Aschauer UJ, Bowen P. Transparent polycrystalline alumina using spark plasma sintering: Effect of Mg, Y and La doping Journal of the European Ceramic Society. 30: 1335-1343. DOI: 10.1016/J.Jeurceramsoc.2009.12.001 |
0.43 |
|
| 2009 |
Luebbe H, herle JV, Hofmann H, Bowen P, Aschauer UJ, Schuler A, Snijkers F, Schindler H, Vogt U, Lalanne C. Cathode-supported micro-tubular SOFCs based on Nd1.95NiO4+δ: Fabrication and characterisation of dip-coated electrolyte layers Solid State Ionics. 180: 805-811. DOI: 10.1016/J.Ssi.2009.01.010 |
0.433 |
|
| 2009 |
Aschauer UJ, Bowen P, Parker SC. Oxygen vacancy diffusion in alumina: New atomistic simulation methods applied to an old problem Acta Materialia. 57: 4765-4772. DOI: 10.1016/J.Actamat.2009.06.061 |
0.427 |
|
| 2008 |
Galmarini S, Aschauer UJ, Bowen P, Parker SC. Atomistic Simulation of Y‐Doped α‐Alumina Interfaces Journal of the American Ceramic Society. 91: 3643-3651. DOI: 10.1111/J.1551-2916.2008.02619.X |
0.451 |
|
| 2008 |
Aschauer UJ, Bowen P, Parker SC. Surface and Mirror Twin Grain Boundary Segregation in Nd:YAG: An Atomistic Simulation Study Journal of the American Ceramic Society. 91: 2698-2705. DOI: 10.1111/J.1551-2916.2008.02502.X |
0.428 |
|
| 2008 |
Aschauer U, Jones F, Richmond W, Bowen P, Rohl A, Parkinson G, Hofmann H. Growth modification of hematite by phosphonate additives Journal of Crystal Growth. 310: 688-698. DOI: 10.1016/J.Jcrysgro.2007.11.114 |
0.557 |
|
| 2006 |
Aschauer UJ, Bowen P, Parker SC. Atomistic Modeling Study of Surface Segregation in Nd:YAG Journal of the American Ceramic Society. 89: 3812-3816. DOI: 10.1111/J.1551-2916.2006.01325.X |
0.518 |
|
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