| # | Title | Journal | Year | Citations |
|---|
| 1 | Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data | Physical Review Letters | 2009 | 4,824 |
| 2 | Model for the structure of bacteriorhodopsin based on high-resolution electron cryo-microscopy | Journal of Molecular Biology | 1990 | 3,109 |
| 3 | Controlling the Electronic Structure of Bilayer Graphene | Science | 2006 | 3,003 |
| 4 | Towards wafer-size graphene layers by atmospheric pressure graphitization of silicon carbide | Nature Materials | 2009 | 2,396 |
| 5 | Local, Efflux-Dependent Auxin Gradients as a Common Module for Plant Organ Formation | Cell | 2003 | 2,313 |
| 6 | Structure of 20S proteasome from yeast at 2.4Å resolution | Nature | 1997 | 2,214 |
| 7 | Hydrogen as a Cause of Doping in Zinc Oxide | Physical Review Letters | 2000 | 2,051 |
| 8 | The Active Site of Methanol Synthesis over Cu/ZnO/Al 2 O 3 Industrial Catalysts | Science | 2012 | 2,018 |
| 9 | Composition, structure, and stability ofRuO2(110)as a function of oxygen pressure | Physical Review B | 2001 | 1,771 |
| 10 | Zur Vervollkommnung der quantitativen Phytoplankton-Methodik | SIL Communications 1953-1996 | 1958 | 1,537 |
| 11 | Fast and Accurate Modeling of Molecular Atomization Energies with Machine Learning | Physical Review Letters | 2012 | 1,523 |
| 12 | Synergism between vascular endothelial growth factor and placental growth factor contributes to angiogenesis and plasma extravasation in pathological conditions | Nature Medicine | 2001 | 1,484 |
| 13 | Regulation of Polar Auxin Transport by AtPIN1 in Arabidopsis Vascular Tissue | Science | 1998 | 1,424 |
| 14 | Scatter factor/hepatocyte growth factor is essential for liver development | Nature | 1995 | 1,354 |
| 15 | Ab initio pseudopotentials for electronic structure calculations of poly-atomic systems using density-functional theory | Computer Physics Communications | 1999 | 1,313 |
| 16 | Lateral relocation of auxin efflux regulator PIN3 mediates tropism in Arabidopsis | Nature | 2002 | 1,299 |
| 17 | Scanning tunneling microscopy observations on the reconstructed Au(111) surface: Atomic structure, long-range superstructure, rotational domains, and surface defects | Physical Review B | 1990 | 1,218 |
| 18 | Auxin transport inhibitors block PIN1 cycling and vesicle trafficking | Nature | 2001 | 1,174 |
| 19 | Accurate and Efficient Method for Many-Body van der Waals Interactions | Physical Review Letters | 2012 | 1,120 |
| 20 | Universal alignment of hydrogen levels in semiconductors, insulators and solutions | Nature | 2003 | 1,111 |
| 21 | Reactions at Surfaces: From Atoms to Complexity (Nobel Lecture) | Angewandte Chemie - International Edition | 2008 | 1,105 |
| 22 | SchNet – A deep learning architecture for molecules and materials | Journal of Chemical Physics | 2018 | 1,083 |
| 23 | Ionothermal Synthesis of Crystalline, Condensed, Graphitic Carbon Nitride | Chemistry - A European Journal | 2008 | 1,040 |
| 24 | Quasiparticle dynamics in graphene | Nature Physics | 2007 | 1,035 |
| 25 | Machine learning in materials informatics: recent applications and prospects | Npj Computational Materials | 2017 | 1,013 |
| 26 | Interlayer cohesive energy of graphite from thermal desorption of polyaromatic hydrocarbons | Physical Review B | 2004 | 972 |
| 27 | Metal deposits on well-ordered oxide films | Progress in Surface Science | 1999 | 931 |
| 28 | Superior Storage Performance of a Si@SiOx/C Nanocomposite as Anode Material for Lithium‐Ion Batteries | Angewandte Chemie - International Edition | 2008 | 910 |
| 29 | Quantum-chemical insights from deep tensor neural networks | Nature Communications | 2017 | 884 |
| 30 | Immunoglobulin heavy chain binding protein | Nature | 1983 | 851 |
| 31 | Culture in whales and dolphins | Behavioral and Brain Sciences | 2001 | 848 |
| 32 | AtPIN2 defines a locus of Arabidopsis for root gravitropism control | EMBO Journal | 1998 | 840 |
| 33 | Atomic-Scale Structure and Catalytic Reactivity of the RuO2(110) Surface | Science | 2000 | 829 |
| 34 | Symbol Nomenclature for Graphical Representations of Glycans | Glycobiology | 2015 | 818 |
| 35 | The Roles of Subsurface Carbon and Hydrogen in Palladium-Catalyzed Alkyne Hydrogenation | Science | 2008 | 800 |
| 36 | Coherent terahertz control of antiferromagnetic spin waves | Nature Photonics | 2011 | 788 |
| 37 | Work function of small metal particles: Self-consistent spherical jellium-background model | Physical Review B | 1984 | 785 |
| 38 | Increased Silver Activity for Direct Propylene Epoxidation via Subnanometer Size Effects | Science | 2010 | 783 |
| 39 | New tolerance factor to predict the stability of perovskite oxides and halides | Science Advances | 2019 | 778 |
| 40 | Astrocytes present myelin basic protein to encephalitogenic T-cell lines | Nature | 1984 | 774 |
| 41 | AtPIN4 Mediates Sink-Driven Auxin Gradients and Root Patterning in Arabidopsis | Cell | 2002 | 763 |
| 42 | Coordinated Polar Localization of Auxin Efflux Carrier PIN1 by GNOM ARF GEF | Science | 1999 | 754 |
| 43 | Spatiotemporal concentration patterns in a surface reaction: Propagating and standing waves, rotating spirals, and turbulence | Physical Review Letters | 1990 | 695 |
| 44 | Machine learning of accurate energy-conserving molecular force fields | Science Advances | 2017 | 695 |
| 45 | Extracellular synthesis of silver nanoparticles by a silver-tolerant yeast strain MKY3 | Nanotechnology | 2003 | 679 |
| 46 | Interlayer Interaction and Electronic Screening in Multilayer Graphene Investigated with Angle-Resolved Photoemission Spectroscopy | Physical Review Letters | 2007 | 678 |
| 47 | Scatter factor/hepatocyte growth factor and its receptor, the c-met tyrosine kinase, can mediate a signal exchange between mesenchyme and epithelia during mouse development. | Journal of Cell Biology | 1993 | 677 |
| 48 | The chemisorption of carbon monoxide on palladium single crystal surfaces: IR spectroscopic evidence for localised site adsorption | Surface Science | 1978 | 664 |
| 49 | Big Data of Materials Science: Critical Role of the Descriptor | Physical Review Letters | 2015 | 658 |
| 50 | Structures of Neutral Au 7 , Au 19 , and Au 20 Clusters in the Gas Phase | Science | 2008 | 596 |
