Reinhard Hentschke - Publications

Affiliations: 
1990 Chemistry Brandeis University, Waltham, MA, United States 

77 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2019 Engelmann S, Hentschke R. Specific heat capacity enhancement studied in silica doped potassium nitrate via molecular dynamics simulation. Scientific Reports. 9: 7606. PMID 31110229 DOI: 10.1038/S41598-019-44132-3  0.314
2019 Gundlach N, Hentschke R, Karimi-Varzaneh HA. Filler flocculation in elastomer blends - an approach based on measured surface tensions and monte carlo simulation Soft Materials. 17: 283-296. DOI: 10.1080/1539445X.2019.1568261  0.322
2018 Gundlach N, Hentschke R. Modelling Filler Dispersion in Elastomers: Relating Filler Morphology to Interface Free Energies via SAXS and TEM Simulation Studies. Polymers. 10. PMID 30966481 DOI: 10.3390/Polym10040446  0.385
2017 Meyer J, Hentschke R, Hager J, Hojdis NW, Karimi-Varzaneh HA. A nano-mechanical instability as primary contribution to rolling resistance. Scientific Reports. 7: 11275. PMID 28900212 DOI: 10.1038/S41598-017-11728-6  0.327
2017 Meyer J, Hentschke R, Hager J, Hojdis NW, Karimi-Varzaneh HA. Molecular Simulation of Viscous Dissipation due to Cyclic Deformation of a Silica–Silica Contact in Filled Rubber Macromolecules. 50: 6679-6689. DOI: 10.1021/Acs.Macromol.7B00947  0.389
2016 Hentschke R, Ballnus C, Meyer J. Remarks on the Interpretation of IR-Absorption Studies Applied to the Surfaces of Silica Nanoparticles Journal of Physical Chemistry C. 120: 9229-9235. DOI: 10.1021/Acs.Jpcc.6B00807  0.327
2015 Hager J, Hentschke R, Hojdis NW, Karimi-Varzaneh HA. Computer Simulation of Particle–Particle Interaction in a Model Polymer Nanocomposite Macromolecules. 48: 9039-9049. DOI: 10.1021/Acs.Macromol.5B01864  0.366
2014 Xi H, Hentschke R. The influence of structure on mechanical properties of filler networks via coarse-grained modeling Macromolecular Theory and Simulations. 23: 373-382. DOI: 10.1002/Mats.201400009  0.323
2014 Hentschke R, Hager J, Hojdis NW. Molecular modeling approach to the prediction of mechanical properties of silica-reinforced rubbers Journal of Applied Polymer Science. 131: 1514. DOI: 10.1002/App.40806  0.4
2013 Braun H, Hentschke R. Phase coexistence for charged soft dumbbell and ionic soft sphere systems via molecular dynamics simulation. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 87: 012311. PMID 23410335 DOI: 10.1103/Physreve.87.012311  0.414
2012 Guse C, Hentschke R. Simulation study of structural, transport, and thermodynamic properties of TIP4P/2005 water in single-walled carbon nanotubes. The Journal of Physical Chemistry. B. 116: 751-62. PMID 22171918 DOI: 10.1021/Jp210193W  0.314
2012 Xi H, Hentschke R. Dynamic moduli of filled elastomers - A coarse grained computer model European Polymer Journal. 48: 1777-1786. DOI: 10.1016/J.Eurpolymj.2012.07.005  0.332
2011 Jia R, Hentschke R. Simulation study of the polarizable Stockmayer fluid in an external field. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 84: 051508. PMID 22181423 DOI: 10.1103/Physreve.84.051508  0.348
2011 Schreiber S, Hentschke R. Monte Carlo simulation of osmotic equilibria. The Journal of Chemical Physics. 135: 134106. PMID 21992281 DOI: 10.1063/1.3644766  0.345
2010 Guse C, Simionescu A, Schünemann B, Hentschke R, Bomsdorf H. Temperature-dependent structure of liquid water investigated by means of energy-dispersive x-ray diffraction and molecular dynamics simulations Journal of Physics Condensed Matter. 22. PMID 21386487 DOI: 10.1088/0953-8984/22/32/325105  0.333
2010 Jia R, Braun H, Hentschke R. Gas-liquid coexistence in a system of dipolar soft spheres. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 82: 062501. PMID 21230693 DOI: 10.1103/Physreve.82.062501  0.357
2010 Hörstermann H, Hentschke R, Amkreutz M, Hoffmann M, Wirts-Rütters M. Predicting water sorption and volume swelling in dense polymer systems via computer simulation. The Journal of Physical Chemistry. B. 114: 17013-24. PMID 21141921 DOI: 10.1021/Jp105210Y  0.394
2009 Jia R, Hentschke R. Dipolar particles in an external field: Molecular dynamics simulation and mean field theory. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 80: 051502. PMID 20364987 DOI: 10.1103/Physreve.80.051502  0.37
2009 Braun H, Hentschke R. Tracking gas-liquid coexistence in fluids of charged soft dumbbells. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 80: 041501. PMID 19905310 DOI: 10.1103/Physreve.80.041501  0.389
2009 Ouyang WZ, Hentschke R. Phase behavior of a reversibly assembling system in two dimensions: a Monte Carlo simulation study. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 79: 031503. PMID 19391946 DOI: 10.1103/Physreve.79.031503  0.431
2008 Hörstermann H, Hentschke R. Effects due to molecular shape and flexibility on the permeability ratio of binary fluid mixtures in a model polymer network via computer simulation. The Journal of Chemical Physics. 128: 084902. PMID 18315082 DOI: 10.1063/1.2839435  0.363
2008 Hentschke R, Bartke J. Reply to “Comment on ‘Equilibrium polymerization and gas-liquid critical behavior in the Stockmayer fluid'” Physical Review E. 77: 13502. DOI: 10.1103/Physreve.77.013502  0.371
2007 Ouyang WZ, Hentschke R. From gas-liquid to liquid crystalline phase behavior via anisotropic attraction: a computer simulation study. The Journal of Chemical Physics. 127: 164501. PMID 17979354 DOI: 10.1063/1.2799195  0.442
2007 Bartke J, Hentschke R. Phase behavior of the Stockmayer fluid via molecular dynamics simulation. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 75: 061503. PMID 17677265 DOI: 10.1103/Physreve.75.061503  0.434
2007 Hentschke R, Bartke J, Pesth F. Equilibrium polymerization and gas-liquid critical behavior in the Stockmayer fluid. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 75: 011506. PMID 17358159 DOI: 10.1103/Physreve.75.011506  0.4
2007 Hörstermann H, Hentschke R. Volumetric Changes of Randomly Crosslinked Model Networks Macromolecular Theory and Simulations. 16: 407-411. DOI: 10.1002/Mats.200600088  0.371
2006 Bartke J, Hentschke R. Dielectric properties and the ferroelectric transition of the Stockmayer-fluid via computer simulation Molecular Physics. 104: 3057-3068. DOI: 10.1080/00268970600961990  0.39
2006 Kabrede H, Hentschke R. Spinodal decomposition in a 3D Lennard–Jones system Physica a-Statistical Mechanics and Its Applications. 361: 485-493. DOI: 10.1016/J.Physa.2005.06.054  0.392
2005 Oyen E, Hentschke R. Computer simulation of polymer networks: swelling by binary Lennard-Jones mixtures. The Journal of Chemical Physics. 123: 054902. PMID 16108688 DOI: 10.1063/1.1979497  0.407
2005 Hentschke R, Oyen E. Finite size effects in tightly meshed polymer networks. The Journal of Chemical Physics. 122: 104904. PMID 15836355 DOI: 10.1063/1.1860551  0.347
2004 Lenz PB, Hentschke R. Concentration dependent size of reversibly assembling polymers in solution: a mean-field lattice theory. The Journal of Chemical Physics. 121: 10809-13. PMID 15549967 DOI: 10.1063/1.1812259  0.342
2004 and GD, Hentschke R. Atomistically Modeling the Chemical Potential of Small Molecules in Dense Systems Journal of Physical Chemistry B. 108: 2413-2417. DOI: 10.1021/Jp0367427  0.325
2004 Dömötör G, Hentschke R. Equilibrium Swelling of an Epoxy-Resin in Contact with Water – A Molecular Dynamics Simulation Study Macromolecular Theory and Simulations. 13: 506-511. DOI: 10.1002/Mats.200400018  0.337
2002 Oyen E, Hentschke R. Molecular Dynamics Simulation of Aqueous Sodium Chloride Solution at the NaCl(001) Interface with a Polarizable Water Model Langmuir. 18: 547-556. DOI: 10.1021/La011269E  0.405
2000 Fodi B, Hentschke R. Simulated phase behavior of reversibly assembled polymers Journal of Chemical Physics. 112: 6917-6924. DOI: 10.1063/1.481320  0.419
2000 Aydt EM, Hentschke R. Swelling of a Model Network: A Gibbs-Ensemble Molecular Dynamics Study Journal of Chemical Physics. 112: 5480-5487. DOI: 10.1063/1.481114  0.431
2000 Eckstein E, Qian J, Hentschke R, Thurn-Albrecht T, Steffen W, Fischer EW. X-Ray Scattering Study and Molecular Simulation of Glass Forming Liquids: Propylene Carbonate and Salol Journal of Chemical Physics. 113: 4751-4762. DOI: 10.1063/1.1288907  0.375
2000 Fodi B, Hentschke R. Simulated Phase Behavior of Model Surfactant Solutions Langmuir. 16: 1626-1633. DOI: 10.1021/La990862H  0.405
1999 Qian J, Hentschke R, Heuer A. On the origin of dynamic heterogeneities in glass-forming liquids Journal of Chemical Physics. 111: 10177-10182. DOI: 10.1063/1.480368  0.355
1999 Stöckelmann E, Hentschke R. A molecular-dynamics simulation study of water on NaCl(100) using a polarizable water model Journal of Chemical Physics. 110: 12097-12107. DOI: 10.1063/1.479145  0.427
1999 Qian J, Hentschke R, Heuer A. Dynamic heterogeneities of translational and rotational motion of a molecular glass former from computer simulations Journal of Chemical Physics. 110: 4514-4522. DOI: 10.1063/1.478334  0.338
1999 Stöckelmann E, Hentschke R. Adsorption Isotherms of Water Vapor on Calcite: a Molecular Dynamics-Monte Carlo Hybrid Simulation Using a Polarizable Water Model Langmuir. 15: 5141-5149. DOI: 10.1021/La981790H  0.406
1998 Fodi B, Hentschke R. Molecular Dynamics Simulation of a Binary Hydrocarbon Mixture near an Adsorbing Wall: Benzene/n-Heptane on Graphite Langmuir. 14: 429-437. DOI: 10.1021/La9706983  0.433
1998 Flebbe T, Hentschke R, Hädicke E, Schade C. Modeling of Polyvinylpyrrolidone and Polyvinylimidazole in Aqueous Solution Macromolecular Theory and Simulations. 7: 567-577. DOI: 10.1002/(Sici)1521-3919(19981101)7:6<567::Aid-Mats567>3.0.Co;2-N  0.392
1997 Qian J, Hentschke R, Knoll W. Superstructures of cyclodextrin derivatives on Au(111): A combined random planting molecular dynamics approach Langmuir. 13: 7092-7098. DOI: 10.1021/La9707484  0.372
1997 Stöckelmann E, Aydt EM, Hentschke R. Simulation of adsorption isotherms of water on ionic surfaces Journal of Molecular Modeling. 3: 347-354. DOI: 10.1007/S008940050049  0.418
1997 Fodi B, Hentschke R. Simulation of Surface Excess Concentrations for a Binary Hydrocarbon Mixture on Graphite Journal of Molecular Modeling. 3: 315-320. DOI: 10.1007/S008940050044  0.395
1997 Hentschke R. Molecular modeling of adsorption and ordering at solid interfaces Macromolecular Theory and Simulations. 6: 287-316. DOI: 10.1002/Mats.1997.040060201  0.387
1996 Kotelyanskii MJ, Hentschke R. Gibbs-Ensemble Molecular Dynamics: Liquid-Gas Equilibria for Lennard-Jones Spheres and n-Hexane Molecular Simulation. 17: 95-112. DOI: 10.1080/08927029608024099  0.435
1996 Matties MA, Hentschke R. Molecular dynamics simulation of benzene on graphite .2. Phase behavior of adsorbed multilayers Langmuir. 12: 2501-2504. DOI: 10.1021/La950767I  0.429
1996 Bast T, Hentschke R. Molecular dynamics simulation of a micellar system: 2,3,6,7,10,11-hexakis(1,4,7-trioxaoctyl)triphenylene in water The Journal of Physical Chemistry. 100: 12162-12171. DOI: 10.1021/Jp953790L  0.373
1996 Bast T, Hentschke R. Molecular Dynamics Simulation of a Micellar System Journal of Molecular Modeling. 2: 330-340. DOI: 10.1007/S0089460020330  0.44
1996 Hentschke R, Bast T, Aydt E, Kotelyanskii M. Gibbs-ensemble molecular dynamics: A new method for simulations involving particle exchange Journal of Molecular Modeling. 2: 319-326. DOI: 10.1007/S0089460020319  0.433
1995 Kotelyanskii MJ, Hentschke R. Gibbs-Ensemble Molecular-Dynamics - Liquid-Gas Equilibrium In A Lennard-Jones System Physical Review E. 51: 5116-5119. PMID 9963228 DOI: 10.1103/Physreve.51.5116  0.392
1995 Cincotti S, Burda J, Hentschke R, Rabe JP. Calculation of monolayer structures of hydrocarbon chains on transition metal dichalcogenides: Dotriacontane on MoSe2. Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 51: 2090-2098. PMID 9962869 DOI: 10.1103/Physreve.51.2090  0.354
1995 Helfrich J, Hentschke R. Molecular-Dynamics Simulation Of Macromolecular Interactions In Solution - Poly(Gamma-Benzyl Glutamate) In Dimethylformamide And Tetrahydrofuran Macromolecules. 28: 3831-3841. DOI: 10.1021/Ma00115A013  0.41
1995 Apel UM, Hentschke R, Helfrich J. Molecular-Dynamics Simulation Of Syndiotactic And Isotactic Poly(Methyl Methacrylate) In Benzene Macromolecules. 28: 1778-1785. DOI: 10.1021/Ma00110A009  0.397
1994 Kotelyanskii MJ, Hentschke R. Computer-simulation study of the interface between graphite and hydrocarbon mixtures: Preferential adsorption and dynamics. Physical Review E. 49: 910-913. PMID 9961286 DOI: 10.1103/Physreve.49.910  0.371
1994 Winkler RG, Hentschke R. Comparative Molecular-Dynamics Simulation Study Of The Benzene-Graphite And The Benzene-1,12-Dodecanediol-Graphite Interface Journal of Chemical Physics. 100: 3930-3939. DOI: 10.1063/1.466328  0.387
1994 Helfrich J, Hentschke R, Apel UM. Molecular dynamics simulation study of poly(.gamma.-benzyl L-glutamate) in dimethylformamide Macromolecules. 27: 472-482. DOI: 10.1021/Ma00080A022  0.416
1994 Hentschke R. A Model Ladder Polymer Physisorbed On A Lennard-Jones Surface Macromolecular Theory and Simulations. 3: 677-693. DOI: 10.1002/Mats.1994.040030404  0.304
1994 Helfrich J, Hentschke R, Apel U. Simulation Study Of Poly(Gamma-Benzyl-L-Glutamate) In Dimethylformamide Macromolecular Symposia. 81: 369-375. DOI: 10.1002/Masy.19940810138  0.371
1994 Hentschke R, Edwards PJB, Boden N, Bushby RJ. A Model For Isotropic, Nematic, And Columnar Ordering In A Self-Assembling System - Comparison With The Phase-Behavior Of 2,3,6,7,10,11-Hexa-(1,4,7-Trioxaoctyl)-Triphenylene In Water Macromolecular Symposia. 81: 361-367. DOI: 10.1002/Masy.19940810137  0.367
1994 Hentschke R, Kotelyanskii MJ, Winkler RG. Molecular-Dynamics Simulation Studies Of A Complex Fluid-Solid Interface - The Benzene-Alkane-Graphite System Macromolecular Symposia. 81: 213-219. DOI: 10.1002/Masy.19940810125  0.384
1993 Winkler RG, Hentschke R. Liquid benzene confined between graphite surfaces. A constant pressure molecular dynamics study Journal of Chemical Physics. 99: 5405-5417. DOI: 10.1063/1.466223  0.402
1993 Hentschke R, Winkler RG. Molecular dynamics simulation study of the adsorption of chain alkanes from solution onto graphite Journal of Chemical Physics. 99: 5528-5534. DOI: 10.1063/1.465971  0.389
1993 Hentschke R, Schürmann BL, Rabe JP. Erratum: Molecular dynamics simulations of ordered alkane chains physisorbed on graphite [J. Chem. Phys. 96, 6213 (1992)] Journal of Chemical Physics. 98: 1756-1757. DOI: 10.1063/1.465125  0.398
1992 Hentschke R, Schürmann BL, Rabe JP. Molecular dynamics simulations of ordered alkane chains physisorbed on graphite Journal of Chemical Physics. 96: 6213-6221. DOI: 10.1063/1.462612  0.411
1992 Hentschke R, Schürmann BL. A molecular dynamics simulation of liquid benzene adsorbed on graphite Surface Science. 262: 180-188. DOI: 10.1016/0039-6028(92)90470-Q  0.413
1991 Hentschke R, Herzfeld J. Theory of nematic order with aggregate dehydration for reversibly assembling proteins in concentrated solutions: Application to sickle-cell hemoglobin polymers. Physical Review. A. 43: 7019-7030. PMID 9905053 DOI: 10.1103/Physreva.43.7019  0.532
1991 Hentschke R. Effect of persistent flexibility on the isotropic, nematic and columnar ordering in a self-assembling system Liquid Crystals. 10: 691-702. DOI: 10.1080/02678299108241736  0.357
1989 Taylor MP, Hentschke R, Herzfeld J. Theory of ordered phases in a system of parallel hard spherocylinders. Physical Review Letters. 62: 800-803. PMID 10040336 DOI: 10.1103/Physrevlett.62.800  0.517
1989 Hentschke R, Taylor MP, Herzfeld J. Equation of state for parallel hard spherocylinders. Physical Review. A. 40: 1678-1680. PMID 9902312 DOI: 10.1103/Physreva.40.1678  0.561
1989 Hentschke R, Herzfeld J. Dehydration of Protein Polymers in Concentrated Nematic Solutions Mrs Proceedings. 177. DOI: 10.1557/Proc-177-305  0.527
1989 Hentschke R, Herzfeld J. Soft repulsions in a lattice model for liquid crystalline order in self-assembling systems The Journal of Chemical Physics. 91: 7308-7309. DOI: 10.1063/1.457303  0.579
1989 Hentschke R, Herzfeld J. Nematic behavior of reversibly polymerizing proteins Journal of Chemical Physics. 90: 5094-5101. DOI: 10.1063/1.456692  0.373
1988 Hentschke R, Kleban P. Multiple scattering at surface critical points Surface Science. 202: 533-564. DOI: 10.1016/0039-6028(88)90052-0  0.307
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