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Publications of the NIC Research Group 2011-2016

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Meeting the Contact-Mechanics Challenge
Tribology letters 65(4), 118 () [10.1007/s11249-017-0900-2]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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A Green’s Function Molecular Dynamics Approach to the Mechanical Contact between Thin Elastic Sheets and Randomly Rough Surfaces
Biomimetics 1(1), 7 - () [10.3390/biomimetics1010007] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Constraints on phase stability, defect energies, and elastic constants of metals described by EAM-type potentials
Journal of physics / Condensed matter 28(39), 395701 - () [10.1088/0953-8984/28/39/395701]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Contact Mechanics and Fluid Leakage Near Percolation
NIC Symposium 2016
NIC Symposium 2016, JülichJülich, Germany, 11 Feb 2016 - 12 Feb 20162016-02-112016-02-12
Jülich : Forschungszentrum Jülich GmbH, Zentralbibliothek, NIC Series 48, 21-29 () OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Dynamic shear force microscopy of viscosity in nanometer-confined hexadecane layers
Journal of physics / Condensed matter 28(13), 134004 - () [10.1088/0953-8984/28/13/134004]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Fluid leakage near the percolation threshold
Scientific reports 6, 19513 () [10.1038/srep19513] OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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A dimensionless measure for adhesion and effects of the range of adhesion in contacts of nominally flat surfaces
Tribology international 100, 41-47 () [10.1016/j.triboint.2015.11.010]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Hydroxyapatite Growth Inhibition Effect of Pellicle Statherin Peptides
Journal of dental research 94(8), 1106 - 1112 () [10.1177/0022034515586769]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Theoretical Studies of Superlubricity
Fundamentals of Friction and Wear on the Nanoscale / Gnecco, Enrico (Editor) , Chapter 11 ; ISBN: 978-3-319-10559-8=978-3-319-10560-4 ; Cham : Springer International Publishing, NanoScience and Technology 209 - 232 () [10.1007/978-3-319-10560-4_11] BibTeX | EndNote: XML, Text | RIS

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Charge-transfer potentials for ionic crystals: Cauchy violation, LO-TO splitting, and the necessity of an ionic reference state
The journal of chemical physics 143(22), 224101 - () [10.1063/1.4936575] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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On the friction and adhesion hysteresis between polymer brushes attached to curved surfaces: Rate and solvation effects
Friction 3(2), 148 - 160 () [10.1007/s40544-015-0078-2] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Systematic analysis and modification of embedded-atom potentials: case study of copper
Modelling and simulation in materials science and engineering 23(7), 074001 - () [10.1088/0965-0393/23/7/074001]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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High-order sampling schemes for path integrals and Gaussian chain simulations of polymers
The journal of chemical physics 142(17), 174105 - () [10.1063/1.4919311] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Workshop on Force-Field Development (Forces 2014)
Innovatives Supercomputing in Deutschland 13(1), 112 () OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Contact mechanics of and Reynolds flow through saddle points: On the coalescence of contact patches and the leakage rate through near-critical constrictions
epl 109(4), 44001 () [10.1209/0295-5075/109/44001] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Switchable Friction Using Contacts of Stimulus-Responsive and Nonresponding Swollen Polymer Brushes
Langmuir 30(27), 8085 - 8090 () [10.1021/la5013473]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Preparation and Friction Force Microscopy Measurements of Immiscible, Opposing Polymer Brushes
Journal of visualized experiments 94, 52285 () [10.3791/52285] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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On the Contact Area and Mean Gap of Rough, Elastic Contacts: Dimensional Analysis, Numerical Corrections, and Reference Data
Tribology letters 53(2), 433 - 448 () [10.1007/s11249-013-0282-z] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Force microscopy of layering and friction in an ionic liquidus
Journal of physics / Condensed matter 26(28), 284110 () [10.1088/0953-8984/26/28/284110]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Single-asperity contact mechanics with positive and negative work of adhesion: Influence of finite-range interactions and a continuum description for the squeeze-out of wetting fluids
Beilstein journal of nanotechnology 5, 419 - 437 () [10.3762/bjnano.5.50] BibTeX | EndNote: XML, Text | RIS

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Systematic analysis of Persson's contact mechanics theory of randomly rough elastic surfaces
Journal of physics / Condensed matter 26(35), 355002 () [10.1088/0953-8984/26/35/355002] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Solvent-induced immiscibility of polymer brushes eliminates dissipation channels
Nature Communications 5, 3781 () [10.1038/ncomms4781] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Atomic structure and energetics of amorphous-crystalline CuZr interfaces: a molecular dynamics study
Modelling and simulation in materials science and engineering 22(6), 065007 () [10.1088/0965-0393/22/6/065007]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Friction in (Im-) Miscible Polymer Brush Systems and the Role of Transverse Polymer Tilting
Macromolecules 47(21), 7666 - 7673 () [10.1021/ma501718b]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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New Design Principles for Biomimetic Mechanical Contacts by Computer
Innovatives Supercomputing in Deutschland 12(2), 12-17 () OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Landau theory for stress-induced order-disorder transitions in phase change materials
Physical review / B 89(5), 054101 () [10.1103/PhysRevB.89.054101] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Atomistic Modelling of Redox Reactions in Non-Equilibrium
NIC Symposium 2014 - Proceedings
NIC Symposium 2014, JülichJülich, Germany, 12 Feb 2014 - 13 Feb 20142014-02-122014-02-13
Jülich : John von Neumann Institute for Computing, NIC Series 47, 25-32 () OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Hybrid Particle-Continuum Methods in Computational Materials Physics - Proceedings
Hybrid Particle-Continuum Methods in Computational Materials Physics, JülichJülich, Germany, 4 Mar 2013 - 7 Mar 20132013-03-042013-03-07 Jülich : Forschungszentrum Jülich GmbH Zentralbibliothek, Verlag, Publication Series of the John von Neumann Institute for Computing (NIC) NIC Series 46, ii, 232 pages () OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Modelling the Dielectric Response of Atomistic and Continuous Media with the Split-Charge Method
Hybrid Particle-Continuum Methods in Computational Materials Physics
Hybrid Particle-Continuum Methods in Computational Materials Physics, HYBRID2013, JülichJülich, Germany, 4 Mar 2013 - 7 Mar 20132013-03-042013-03-07
Jülich : John von Neumann Institute for Computing (NIC), NIC Series 46, 171-186 () BibTeX | EndNote: XML, Text | RIS

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Modeling Charge Distributions and Dielectric Response Functions of Atomistic and Continuous Media
Multiscale Modelling Methods for Applications in Materials Science
CECAM Tutorial Multiscale Modelling Methods for Applications in Materials Science, JülichJülich, Germany, 16 Sep 2013 - 20 Sep 20132013-09-162013-09-20
Jülich : Forschungszentrum Jülich GmbH, Zentralbibliothek, Verlag, IAS Series 19, 115-134 ()   Download fulltextFulltext BibTeX | EndNote: XML, Text | RIS

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Finite-size scaling in the interfacial stiffness of rough elastic contacts
Physical review / E 87(6), 062809 () [10.1103/PhysRevE.87.062809] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Towards time-dependent, non-equilibrium charge-transfer force fields
The European physical journal / B 86(7), 337 () [10.1140/epjb/e2013-40047-x]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Redox reactions with empirical potentials: Atomistic battery discharge simulations
The journal of chemical physics 139(6), 064106 - () [10.1063/1.4817772] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Atomic force microscopy of confined liquids using the thermal bending fluctuations of the cantilever
Physical review / E 87(6), 062406 () [10.1103/PhysRevE.87.062406] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Alternative dissipation mechanisms and the effect of the solvent in friction between polymer brushes on rough surfaces
Soft matter 9(30), 7234 - 7241 () [10.1039/c3sm50491c]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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NIC Workshop: Hybrid Particle-Continuum Methods in Computational Materials Physics
Innovatives Supercomputing in Deutschland 11(1), 96 () OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Hybrid Particle-Continuum Methods in Computational Materials Physics
Workshop on Hybrid Particle-Continuum Methods in Computational Materials Physics, HYBRID2013, JülichJülich, Germany, 4 Mar 2013 - 7 Mar 20132013-03-042013-03-07 Jülich : John von Neumann Institute for Computing (NIC), NIC Series 46, 232 p. () OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Contact Mechanics of Laser-Textured Surfaces
Tribology letters 50(1), 41-48 () [10.1007/s11249-012-0064-z]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Dry Friction Between Laser-Patterned Surfaces: Role of Alignment, Structural Wavelength and Surface Chemistry
Tribology letters 49(1), 193 - 202 () [10.1007/s11249-012-0057-y]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Bridging the gap: disk formation in the Class 0 phase with ambipolar diffusion and Ohmic dissipation
Astronomy and astrophysics 541, A35 - () [10.1051/0004-6361/201117876]  Download fulltext Files  Download fulltextFulltext BibTeX | EndNote: XML, Text | RIS

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The chemical hardness of molecules and the band gap of solids within charge equilibration formalisms
The European physical journal / B 85(4), 135 () [10.1140/epjb/e2012-21081-8]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Viewpoint: Surface Folds Make Tears and Chips
Physics 5, 100 () [10.1103/Physics.5.100] BibTeX | EndNote: XML, Text | RIS

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Self-Affine Elastic Contacts: Percolation and Leakage
Physical review letters 108, 244301 () [10.1103/PhysRevLett.108.244301] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Computational Materials Physics at the JSC
NIC Symposium 2012 - Proceedings, edited by K. Binder, G. Münster, M. Kremer, John von Neumann Institute for Computing, 2012, NIC Series Vol. 45, 978-3-89336-758-0, S. 25 - 32 BibTeX | EndNote: XML, Text | RIS

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Statics and dynamics of single polymers confined between two corrugated walls
Proceedings of SAIP2011, the 56th Annual Conference of the South African Institute of Physics, edited by I. Basson and A.E.Botha, (University of South Africa, Pretoria), South African Institute of Physics, 2011, 978-1-86888-688-3, 225 - 231 BibTeX | EndNote: XML, Text | RIS

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Velocity dependence of kinetic friction in the Prandtl-Tomlinson model
Physical review / B 84, 125419 () [10.1103/PhysRevB.84.125419] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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New NIC Research Group at Jülich Supercomputing Centre
Innovatives Supercomputing in Deutschland: inSiDE 9(2), 82 - 83 () OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS


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