| Year |
Citation |
Score |
| 2020 |
Rost CM, Borman T, Hossain MD, Lim M, Quiambao-Tomko KF, Tomko JA, Brenner DW, Maria J, Hopkins PE. Electron and phonon thermal conductivity in high entropy carbides with variable carbon content Acta Materialia. 196: 231-239. DOI: 10.1016/J.Actamat.2020.06.005 |
0.32 |
|
| 2019 |
Lim M, Rak Z, Braun JL, Rost CM, Kotsonis GN, Hopkins PE, Maria J, Brenner DW. Influence of mass and charge disorder on the phonon thermal conductivity of entropy stabilized oxides determined by molecular dynamics simulations Journal of Applied Physics. 125: 055105. DOI: 10.1063/1.5080419 |
0.319 |
|
| 2019 |
Harrington TJ, Gild J, Sarker P, Toher C, Rost CM, Dippo OF, McElfresh C, Kaufmann K, Marin E, Borowski L, Hopkins PE, Luo J, Curtarolo S, Brenner DW, Vecchio KS. Phase stability and mechanical properties of novel high entropy transition metal carbides Acta Materialia. 166: 271-280. DOI: 10.1016/J.Actamat.2018.12.054 |
0.311 |
|
| 2018 |
Sarker P, Harrington T, Toher C, Oses C, Samiee M, Maria JP, Brenner DW, Vecchio KS, Curtarolo S. High-entropy high-hardness metal carbides discovered by entropy descriptors. Nature Communications. 9: 4980. PMID 30478375 DOI: 10.1038/S41467-018-07160-7 |
0.303 |
|
| 2018 |
Su L, Krim J, Brenner DW. The Interdependent Roles of Electrostatics and Surface Functionalization on the Adhesion Strengths of Nanodiamonds to Gold in Aqueous Environments Revealed by Molecular Dynamics Simulations. The Journal of Physical Chemistry Letters. PMID 30027746 DOI: 10.1021/Acs.Jpclett.8B01814 |
0.314 |
|
| 2017 |
Li D, Bucholz EW, Peterson G, Reich BJ, Russ JC, Brenner DW. How predictable is plastic damage at the atomic scale? Applied Physics Letters. 110: 091902. DOI: 10.1063/1.4977420 |
0.308 |
|
| 2017 |
Li D, Reich B, Brenner D. Statistical and image analysis for characterizing simulated atomic-scale damage in crystals Computational Materials Science. 135: 119-126. DOI: 10.1016/J.Commatsci.2017.03.054 |
0.355 |
|
| 2016 |
Peterson GCL, Li D, Reich BJ, Brenner D. Spatial prediction of crystalline defects observed in molecular dynamic simulations of plastic damage Journal of Applied Statistics. 1-24. DOI: 10.1080/02664763.2016.1221915 |
0.35 |
|
| 2015 |
Brenner DW, Shenderova OA. Theory and modelling of diamond fracture from an atomic perspective. Philosophical Transactions. Series a, Mathematical, Physical, and Engineering Sciences. 373. PMID 25713444 DOI: 10.1098/Rsta.2014.0139 |
0.302 |
|
| 2015 |
Brenner DW, Lu S, O'Brien CJ, Bucholz EW, Rak Z. A particle assembly/constrained expansion (PACE) model for the formation and structure of porous metal oxide deposits on nuclear fuel rods in pressurized light water reactors Journal of Nuclear Materials. 457: 209-212. DOI: 10.1016/J.Jnucmat.2014.11.061 |
0.312 |
|
| 2014 |
Lu S, Brenner DW. Studying motion of (100) tilt grain boundaries using molecular dynamics simulation Materials Research Society Symposium Proceedings. 1704. DOI: 10.1557/Opl.2014.805 |
0.357 |
|
| 2014 |
Rák Z, O'Brien CJ, Brenner DW. First-principles investigation of boron incorporation into CRUD under Pressurized Water Reactor conditions Materials Research Society Symposium Proceedings. 1709. DOI: 10.1557/Opl.2014.748 |
0.313 |
|
| 2014 |
O'Brien CJ, Rák Z, Brenner DW. Calculated stability and structure of nickel ferrite crystal surfaces in hydrothermal environments Journal of Physical Chemistry C. 118: 5414-5423. DOI: 10.1021/Jp5002308 |
0.314 |
|
| 2014 |
O'Brien CJ, Rák Z, Bucholz EW, Brenner DW. First principles calculations predict stable 50 nm nickel ferrite particles in PWR coolant Journal of Nuclear Materials. 454: 77-80. DOI: 10.1016/J.Jnucmat.2014.07.049 |
0.315 |
|
| 2014 |
Rák Z, O'Brien CJ, Brenner DW. First-principles investigation of boron defects in nickel ferrite spinel Journal of Nuclear Materials. 452: 446-452. DOI: 10.1016/J.Jnucmat.2014.05.031 |
0.315 |
|
| 2013 |
Lu S, Brenner DW. New perturbation method for predicting solute segregation energies for symmetric tilt grain boundaries Materials Research Society Symposium Proceedings. 1554. DOI: 10.1557/Opl.2013.1098 |
0.355 |
|
| 2013 |
Brenner DW. Challenges to marrying atomic and continuum modeling of materials Current Opinion in Solid State and Materials Science. 17: 257-262. DOI: 10.1016/J.Cossms.2013.07.005 |
0.316 |
|
| 2012 |
Adiga SP, Brenner DW. Stimuli-Responsive Polymer Brushes for Flow Control through Nanopores. Journal of Functional Biomaterials. 3: 239-56. PMID 24955529 DOI: 10.3390/Jfb3020239 |
0.677 |
|
| 2012 |
Dongare AM, Lamattina B, Irving DL, Rajendran AM, Zikry MA, Brenner DW. An angular-dependent embedded atom method (A-EAM) interatomic potential to model thermodynamic and mechanical behavior of Al/Si composite materials Modelling and Simulation in Materials Science and Engineering. 20. DOI: 10.1088/0965-0393/20/3/035007 |
0.316 |
|
| 2012 |
Gibson NM, Luo TJM, Shenderova O, Koscheev AP, Brenner DW. Electrostatically mediated adsorption by nanodiamond and nanocarbon particles Journal of Nanoparticle Research. 14. DOI: 10.1007/S11051-011-0700-9 |
0.702 |
|
| 2011 |
Gibson NM, Luo TJ, Brenner DW, Shenderova O. Immobilization of mycotoxins on modified nanodiamond substrates. Biointerphases. 6: 210-7. PMID 22239814 DOI: 10.1116/1.3672489 |
0.693 |
|
| 2011 |
Dongare AM, Rajendran AM, Lamattina B, Zikry MA, Brenner DW. Dynamic failure behavior of nanocrystalline Cu at atomic scales Computers, Materials and Continua. 24: 43-60. DOI: 10.3970/Cmc.2011.024.043 |
0.315 |
|
| 2011 |
Adiga SP, Adiga VP, Carpick RW, Brenner DW. The vibrational properties of ultrananocrystalline diamond based on molecular dynamics simulations Materials Research Society Symposium Proceedings. 1404: 15-20. DOI: 10.1557/Opl.2012.268 |
0.719 |
|
| 2011 |
Elkhodary K, Lee W, Sun LP, Brenner DW, Zikry MA. Deformation mechanisms of an Ω precipitate in a high-strength aluminum alloy subjected to high strain rates Journal of Materials Research. 26: 487-497. DOI: 10.1557/Jmr.2010.29 |
0.313 |
|
| 2011 |
Adiga SP, Adiga VP, Carpick RW, Brenner DW. Vibrational properties and specific heat of ultrananocrystalline diamond: Molecular dynamics simulations Journal of Physical Chemistry C. 115: 21691-21699. DOI: 10.1021/Jp207424M |
0.725 |
|
| 2011 |
Hu Y, Brenner DW, Shi Y. Detonation initiation from spontaneous hotspots formed during cook-off observed in molecular dynamics simulations Journal of Physical Chemistry C. 115: 2416-2422. DOI: 10.1021/Jp109583G |
0.367 |
|
| 2011 |
Purohit Y, Sun L, Shenderova O, Scattergood RO, Brenner DW. First-principles-based mesoscale modeling of the solute-induced stabilization of 〈1 0 0〉 tilt grain boundaries in an Al-Pb alloy Acta Materialia. 59: 7022-7028. DOI: 10.1016/J.Actamat.2011.07.056 |
0.745 |
|
| 2010 |
Garrison BJ, Dawnkaski EJ, Srivastava D, Brenner DW. Molecular dynamics simulations of dimer opening on a diamond {001}(2x1) surface. Science (New York, N.Y.). 255: 835-8. PMID 17756431 DOI: 10.1126/Science.255.5046.835 |
0.361 |
|
| 2010 |
Gibson NM, Luo TJM, Shenderova O, Choi YJ, Brenner DW. Modified nanodiamonds for adsorption of propidium iodide and aflatoxin Materials Research Society Symposium Proceedings. 1236: 132-137. DOI: 10.1557/Proc-1236-Ss09-05 |
0.692 |
|
| 2010 |
Crill JW, Ji X, Irving DL, Brenner DW, Padgett CW. Atomic and multi-scale modeling of non-equilibrium dynamics at metal-metal contacts Modelling and Simulation in Materials Science and Engineering. 18. DOI: 10.1088/0965-0393/18/3/034001 |
0.311 |
|
| 2010 |
Adiga SP, Brenner DW. Molecular basis for neurofilament heavy chain side arm structure modulation by phosphorylation Journal of Physical Chemistry C. 114: 5410-5416. DOI: 10.1021/Jp905671U |
0.694 |
|
| 2010 |
Purohit Y, Sun L, Irving DL, Scattergood RO, Brenner DW. Computational study of the impurity induced reduction of grain boundary energies in nano- and bi-crystalline Al-Pb alloys Materials Science and Engineering A. 527: 1769-1775. DOI: 10.1016/J.Msea.2009.11.034 |
0.753 |
|
| 2010 |
Gibson NM, Luo TJM, Shenderova O, Choi YJ, Fitzgerald Z, Brenner DW. Fluorescent dye adsorption on nanocarbon substrates through electrostatic interactions Diamond and Related Materials. 19: 234-237. DOI: 10.1016/J.Diamond.2009.10.005 |
0.703 |
|
| 2010 |
Dongare AM, Rajendran AM, Lamattina B, Zikry MA, Brenner DW. Tension-compression asymmetry in nanocrystalline Cu: High strain rate vs. quasi-static deformation Computational Materials Science. 49: 260-265. DOI: 10.1016/J.Commatsci.2010.05.004 |
0.325 |
|
| 2010 |
Dongare AM, Rajendran AM, Lamattina B, Brenner DW, Zikry MA. Atomic-scale study of plastic-yield criterion in nanocrystalline Cu at high strain rates Metallurgical and Materials Transactions a: Physical Metallurgy and Materials Science. 41: 523-531. DOI: 10.1007/S11661-009-0113-X |
0.309 |
|
| 2009 |
Elkhodary K, Sun L, Irving DL, Brenner DW, Ravichandran G, Zikry MA. Integrated experimental, atomistic, and microstructurally based finite element investigation of the dynamic compressive behavior of 2139 aluminum Journal of Applied Mechanics, Transactions Asme. 76: 1-9. DOI: 10.1115/1.3129769 |
0.329 |
|
| 2009 |
Dongare AM, Rajendran AM, Lamattina B, Zikry MA, Brenner DW. Atomic scale simulations of ductile failure micromechanisms in nanocrystalline Cu at high strain rates Physical Review B - Condensed Matter and Materials Physics. 80. DOI: 10.1103/Physrevb.80.104108 |
0.327 |
|
| 2009 |
Irving DL, Padgett CW, Brenner DW. Coupled molecular dynamics/continuum simulations of Joule heating and melting of isolated copper-aluminum asperity contacts Modelling and Simulation in Materials Science and Engineering. 17. DOI: 10.1088/0965-0393/17/1/015004 |
0.333 |
|
| 2009 |
Gibson N, Shenderova O, Luo TJM, Moseenkov S, Bondar V, Puzyr A, Purtov K, Fitzgerald Z, Brenner DW. Colloidal stability of modified nanodiamond particles Diamond and Related Materials. 18: 620-626. DOI: 10.1016/J.Diamond.2008.10.049 |
0.684 |
|
| 2009 |
Sun L, Irving DL, Zikry MA, Brenner DW. First-principles investigation of the structure and synergistic chemical bonding of Ag and Mg at the Al | Ω interface in a Al-Cu-Mg-Ag alloy Acta Materialia. 57: 3522-3528. DOI: 10.1016/J.Actamat.2009.04.006 |
0.308 |
|
| 2008 |
Shi Y, Brenner DW. Molecular simulation of the influence of interface faceting on the shock sensitivity of a model plastic bonded explosive. The Journal of Physical Chemistry. B. 112: 14898-904. PMID 18973371 DOI: 10.1021/Jp805690W |
0.302 |
|
| 2008 |
Robertson DH, Brenner DW, White CT. Effects of crystal orientation on the properties of a chemically sustained shock wave in a model energetic material High‐Pressure Science and Technology. 309: 1369-1372. DOI: 10.1063/1.46465 |
0.327 |
|
| 2008 |
Mintmire JW, Robertson DH, Elert ML, Brenner DW, White CT. Molecular dynamics of void collapse mechanisms in shocked media High‐Pressure Science and Technology. 309: 969-972. DOI: 10.1063/1.46196 |
0.344 |
|
| 2008 |
Shi Y, Brenner DW. Jetting and Detonation Initiation in Shock Induced Collapse of Nanometer-Scale Voids Journal of Physical Chemistry C. 112: 6263-6270. DOI: 10.1021/Jp7119735 |
0.333 |
|
| 2008 |
Jang S, Purohit Y, Irving D, Padgett C, Brenner D, Scattergood RO. Molecular dynamics simulations of deformation in nanocrystalline Al-Pb alloys Materials Science and Engineering A. 493: 53-57. DOI: 10.1016/J.Msea.2007.05.130 |
0.743 |
|
| 2008 |
Purohit Y, Jang S, Irving DL, Padgett CW, Scattergood RO, Brenner DW. Atomistic modeling of the segregation of lead impurities to a grain boundary in an aluminum bicrystalline solid Materials Science and Engineering A. 493: 97-100. DOI: 10.1016/J.Msea.2007.05.128 |
0.745 |
|
| 2008 |
Scattergood RO, Koch CC, Murty KL, Brenner D. Strengthening mechanisms in nanocrystalline alloys Materials Science and Engineering A. 493: 3-11. DOI: 10.1016/J.Msea.2007.04.132 |
0.318 |
|
| 2008 |
Jang S, Purohit Y, Irving DL, Padgett C, Brenner D, Scattergood RO. Influence of Pb segregation on the deformation of nanocrystalline Al: Insights from molecular simulations Acta Materialia. 56: 4750-4761. DOI: 10.1016/J.Actamat.2008.05.024 |
0.737 |
|
| 2008 |
Purohit Y, Irving DL, Scattergood RO, Brenner DW. Prediction of energies of <100> tilt boundaries in Al-Pb alloy Materials Research Society Symposium Proceedings. 1056: 209-214. |
0.73 |
|
| 2007 |
Shi Y, Brenner DW. Simulated thermal decomposition and detonation of nitrogen cubane by molecular dynamics. The Journal of Chemical Physics. 127: 134503. PMID 17919033 DOI: 10.1063/1.2779877 |
0.334 |
|
| 2007 |
Purohit Y, Irving DL, Scattergood RO, Brenner DW. Prediction of Energies of <100> Tilt Boundaries in Al-Pb Alloy Mrs Proceedings. 1056. DOI: 10.1557/Proc-1056-Hh01-10 |
0.358 |
|
| 2007 |
Ma JB, Zikry MA, Ashamwi WM, Brenner DW. Hierarchical modeling of nanoindentation and microstructural evolution of face-centered cubic gold aggregates Journal of Materials Research. 22: 627-643. DOI: 10.1557/Jmr.2007.0076 |
0.347 |
|
| 2007 |
Adiga SP, Brenner DW. Toward designing smart nanovalves: Modeling of flow control through nanopores via the helix-coil transition of grafted polypeptide chains Macromolecules. 40: 1342-1348. DOI: 10.1021/Ma0617522 |
0.686 |
|
| 2006 |
Padgett CW, Shenderova O, Brenner DW. Thermal conductivity of diamond nanorods: Molecular simulation and scaling relations. Nano Letters. 6: 1827-31. PMID 16895381 DOI: 10.1021/Nl060588T |
0.322 |
|
| 2006 |
Irving DL, Brenner DW. Diffusion on a self-assembled monolayer: molecular modeling of a bound + mobile lubricant. The Journal of Physical Chemistry. B. 110: 15426-31. PMID 16884264 DOI: 10.1021/Jp0609840 |
0.321 |
|
| 2006 |
Li Y, Brenner DW, Dong X, Sun C. Ab initio study of the role of entropy in the kinetics of acetylene production in filament-assisted diamond growth environments. The Journal of Physical Chemistry. A. 110: 132-40. PMID 16392848 DOI: 10.1021/Jp054914P |
0.505 |
|
| 2006 |
Hu Y, Shenderova OA, Hu Z, Padgett CW, Brenner DW. Carbon nanostructures for advanced composites Reports On Progress in Physics. 69: 1847-1895. DOI: 10.1088/0034-4885/69/6/R05 |
0.558 |
|
| 2006 |
Li Y, Brenner DW. Influence of trace precursors on mass transport and growth rate during sublimation deposition of AlN crystal Journal of Applied Physics. 100. DOI: 10.1063/1.2357423 |
0.498 |
|
| 2005 |
Adiga SP, Brenner DW. Flow control through polymer-grafted smart nanofluidic channels: molecular dynamics simulations. Nano Letters. 5: 2509-14. PMID 16351205 DOI: 10.1021/Nl051843X |
0.701 |
|
| 2005 |
Ma JB, Ashmawi W, Zikry MA, Schall D, Brenner DW. Modeling of nanoindentation and microstructural ductile behavior in metallic material systems Materials Research Society Symposium Proceedings. 841: 317-322. DOI: 10.1557/Proc-841-R11.9 |
0.347 |
|
| 2005 |
Schall JD, Padgett CW, Brenner DW. Ad hoc continuum-atomistic thermostat for modeling heat flow in molecular dynamics simulations Molecular Simulation. 31: 283-288. DOI: 10.1080/08927020512331336898 |
0.337 |
|
| 2005 |
Padgett CW, Brenner DW. A continuum-atomistic method for incorporating Joule heating into classical molecular dynamics simulations Molecular Simulation. 31: 749-757. DOI: 10.1080/08927020500262614 |
0.31 |
|
| 2005 |
Areshkin DA, Shenderova OA, Schall JD, Brenner DW. Self-consistent tight binding model adapted for hydrocarbon systems Molecular Simulation. 31: 585-595. DOI: 10.1080/08927020500044988 |
0.761 |
|
| 2004 |
Li Y, Brenner DW. First principles prediction of the gas-phase precursors for AlN sublimation growth. Physical Review Letters. 92: 075503. PMID 14995868 DOI: 10.1103/Physrevlett.92.075503 |
0.472 |
|
| 2004 |
Zhirnov VV, Shenderova OA, Jaeger DL, Tyler T, Areshkin DA, Brenner DW, Hren JJ. Electron emission properties of detonation nanodiamonds Physics of the Solid State. 46: 657-661. DOI: 10.1134/1.1711444 |
0.735 |
|
| 2004 |
Areshkin DA, Shenderova OA, Schall JD, Adiga SP, Brenner DW. A self-consistent tight binding model for hydrocarbon systems: Application to quantum transport simulation Journal of Physics Condensed Matter. 16: 6851-6866. DOI: 10.1088/0953-8984/16/39/018 |
0.769 |
|
| 2004 |
Padgett CW, Brenner DW. Influence of chemisorption on the thermal conductivity of single-wall carbon nanotubes Nano Letters. 4: 1051-1053. DOI: 10.1021/Nl049645D |
0.327 |
|
| 2004 |
Brenner DW, Schlesser R, Sitar Z, Dalmau R, Collazo R, Li Y. Model for the influence of boron impurities on the morphology of AlN grown by physical vapor transport Surface Science. 560. DOI: 10.1016/J.Susc.2004.05.003 |
0.307 |
|
| 2004 |
Areshkin DA, Shenderova OA, Adiga SP, Brenner DW. Electronic properties of diamond clusters: Self-consistent tight binding simulation Diamond and Related Materials. 13: 1826-1833. DOI: 10.1016/J.Diamond.2004.04.012 |
0.768 |
|
| 2003 |
Shenderova O, Areshkin D, Brenner D. Carbon based nanostructures: diamond clusters structured with nanotubes Materials Research. 6: 11-17. DOI: 10.1590/S1516-14392003000100004 |
0.755 |
|
| 2003 |
Areshkin DA, Shenderova OA, Schall JD, Brenner DW. Convergence acceleration scheme for self-consistent orthogonal-basis-set electronic structure methods Molecular Simulation. 29: 269-286. DOI: 10.1080/0892702031000092197 |
0.737 |
|
| 2003 |
Shenderova OA, Areshkin D, Brenner DW. Bonding and stability of hybrid diamond/nanotube structures Molecular Simulation. 29: 259-268. DOI: 10.1080/0892702021000049691 |
0.733 |
|
| 2003 |
Nazarov AA, Bachurin DV, Shenderova OA, Brenner DW. On the Origin and Energy of Triple Junction Defects Due to the Finite Length of Grain Boundaries Interface Science. 11: 417-424. DOI: 10.1023/A:1026143927269 |
0.338 |
|
| 2003 |
Shenderova O, Brenner D, Ruoff RS. Would Diamond Nanorods Be Stronger than Fullerene Nanotubes? Nano Letters. 3: 805-809. DOI: 10.1021/Nl025949T |
0.342 |
|
| 2003 |
Bachurin DV, Nazarov AA, Shenderova OA, Brenner DW. Diffusion-accomodated rigid-body translations along grain boundaries in nanostructured materials Materials Science and Engineering A. 359: 247-252. DOI: 10.1016/S0921-5093(03)00354-X |
0.342 |
|
| 2003 |
Frankland SJV, Harik VM, Odegard GM, Brenner DW, Gates TS. The stress-strain behavior of polymer-nanotube composites from molecular dynamics simulation Composites Science and Technology. 63: 1655-1661. DOI: 10.1016/S0266-3538(03)00059-9 |
0.333 |
|
| 2002 |
Shenderova OA, Brenner DW. Atomistic simulation of grain boundaries, triple junctions and related disclinations Solid State Phenomena. 87: 205-214. DOI: 10.4028/Www.Scientific.Net/Ssp.87.205 |
0.366 |
|
| 2002 |
Brenner DW, Shenderova OA, Areshkin DA, Schall JD, Frankland SJV. Atomic modeling of carbon-based nanostructures as a tool for developing new materials and technologies Cmes - Computer Modeling in Engineering and Sciences. 3: 643-673. DOI: 10.3970/Cmes.2002.003.643 |
0.757 |
|
| 2002 |
Bernholc J, Brenner D, Buongiorno Nardelli M, Meunier V, Roland C. Mechanical and electrical properties of nanotubes Annual Review of Materials Science. 32: 347-375. DOI: 10.1146/Annurev.Matsci.32.112601.134925 |
0.31 |
|
| 2002 |
Brenner DW, Shenderova OA, Harrison JA, Stuart SJ, Ni B, Sinnott SB. A second-generation reactive empirical bond order (REBO) potential energy expression for hydrocarbons Journal of Physics Condensed Matter. 14: 783-802. DOI: 10.1088/0953-8984/14/4/312 |
0.349 |
|
| 2002 |
Adiga SP, Brenner DW. Virtual Molecular Design of an Environment-Responsive Nanoporous System Nano Letters. 2: 567-572. DOI: 10.1021/Nl025527J |
0.714 |
|
| 2002 |
Frankland SJV, Caglar A, Brenner DW, Griebel M. Molecular simulation of the influence of chemical cross-links on the shear strength of carbon nanotube-polymer interfaces Journal of Physical Chemistry B. 106: 3046-3048. DOI: 10.1021/Jp015591+ |
0.354 |
|
| 2001 |
Frankland SJV, Caglar A, Brenner DW, Griebel M. Reinforcement mechanisms in polymer nanotube composites: Simulated non-bonded and cross-linked systems Materials Research Society Symposium - Proceedings. 633. DOI: 10.1557/Proc-633-A14.17 |
0.363 |
|
| 2001 |
Shenderova OA, Lawson BL, Areshkin D, Brenner DW. Predicted structure and electronic properties of individual carbon nanocones and nanostructures assembled from nanocones Nanotechnology. 12: 191-197. DOI: 10.1088/0957-4484/12/3/302 |
0.747 |
|
| 2001 |
Frankland SJV, Brenner DW. Hydrogen Raman shifts in carbon nanotubes from molecular dynamics simulation Chemical Physics Letters. 334: 18-23. DOI: 10.1016/S0009-2614(00)01454-8 |
0.331 |
|
| 2000 |
Areshkin DA, Shenderova OA, Zhirnov VV, Pal AF, Hren JJ, Brenner DW. Tight binding modelling of properties related to field emission from nanodiamond clusters Materials Research Society Symposium - Proceedings. 621. DOI: 10.1557/Proc-621-R5.16.1 |
0.741 |
|
| 2000 |
Frankl SJV, Brenner DW. Molecular dynamics simulations of polymer-nanotube composites Materials Research Society Symposium - Proceedings. 593: 199-204. DOI: 10.1557/Proc-593-199 |
0.351 |
|
| 2000 |
Nazarov AA, Shenderova OA, Brenner DW. Elastic models of symmetrical 〈001〉 and 〈011〉 tilt grain boundaries in diamond Physical Review B - Condensed Matter and Materials Physics. 61: 928-936. DOI: 10.1103/Physrevb.61.928 |
0.342 |
|
| 2000 |
Shenderova O, Mewkill J, Brenner DW. Nanoindentation as a probe of nanoscale residual stresses: Atomistic simulation results Molecular Simulation. 25: 81-91. DOI: 10.1080/08927020008044114 |
0.323 |
|
| 2000 |
Schall JD, Brenner DW. Molecular dynamics simulations of carbon nanotube rolling and sliding on graphite Molecular Simulation. 25: 73-79. DOI: 10.1080/08927020008044113 |
0.366 |
|
| 2000 |
Li Y, Brenner DW, Dong X, Sun C. First principles prediction of gas-phase composition and substrate temperature for diamond film growth Molecular Simulation. 25: 41-51. DOI: 10.1080/08927020008044111 |
0.49 |
|
| 2000 |
Shenderova OA, Brenner DW, Omeltchenko A, Su X, Yang LH, Nazarov A. Properties of polycrystalline diamond: Multiscale modeling approach Molecular Simulation. 24: 197-207. DOI: 10.1080/08927020008024196 |
0.35 |
|
| 2000 |
Nazarov AA, Shenderova OA, Brenner DW. On the disclination-structural unit model of grain boundaries Materials Science and Engineering A. 281: 148-155. DOI: 10.1016/S0921-5093(99)00727-3 |
0.337 |
|
| 2000 |
Brenner DW. The art and science of an analytic potential Physica Status Solidi (B) Basic Research. 217: 23-40. DOI: 10.1002/(Sici)1521-3951(200001)217:1<23::Aid-Pssb23>3.0.Co;2-N |
0.302 |
|
| 1999 |
Shenderova OA, Brenner DW, Omeltchenko A, Su X, Yang L. Atomistic modeling of grain boundary fracture in diamond Materials Research Society Symposium - Proceedings. 539: 319-324. DOI: 10.1557/Proc-539-319 |
0.314 |
|
| 1999 |
Shenderova OA, Brenner DW. Atomistic simulations of structures and mechanical properties of 〈011〉 tilt grain boundaries and their triple junctions in diamond Physical Review B - Condensed Matter and Materials Physics. 60: 7053-7061. DOI: 10.1103/Physrevb.60.7053 |
0.378 |
|
| 1999 |
Shenderova OA, Brenner DW, Yang LH. Atomistic simulations of structures and mechanical properties of polycrystalline diamond: Symmetrical 〈001〉 tilt grain boundaries Physical Review B - Condensed Matter and Materials Physics. 60: 7043-7052. DOI: 10.1103/Physrevb.60.7043 |
0.378 |
|
| 1999 |
Srivastava D, Brenner DW, Schall JD, Ausman KD, Yu M, Ruoff RS. Predictions of Enhanced Chemical Reactivity at Regions of Local Conformational Strain on Carbon Nanotubes: Kinky Chemistry The Journal of Physical Chemistry B. 103: 4330-4337. DOI: 10.1021/Jp990882S |
0.341 |
|
| 1998 |
Shenderova O, Mewkill J, Linehan P, Brenner DW, Jarausch K, Russell PE. Evaluation of atomic force microscopy as a probe of nanoscale residual stress via atomistic simulation Materials Research Society Symposium - Proceedings. 522: 233-238. DOI: 10.1557/Proc-522-233 |
0.32 |
|
| 1998 |
Shenderova OA, Brenner DW, Nazarov AA, Romanov AE, Yang LH. Multiscale modeling approach for calculating grain-boundary energies from first principles Physical Review B - Condensed Matter and Materials Physics. 57. DOI: 10.1103/Physrevb.57.R3181 |
0.336 |
|
| 1998 |
Brenner DW, Shenderova OA, Areshkin DA. Quantum-Based Analytic Interatomic Forces and Materials Simulation Reviews in Computational Chemistry. 12: 207-239. |
0.706 |
|
| 1997 |
Shenderova O, Brenner DW. Coexistence of two carbon phases at grain boundaries in polycrystalline diamond Materials Research Society Symposium - Proceedings. 442: 693-698. DOI: 10.1557/Proc-442-693 |
0.349 |
|
| 1997 |
Sinnott SB, Colton RJ, White CT, Shenderova OA, Brenner DW, Harrison JA. Atomistic simulations of the nanometer-scale indentation of amorphous-carbon thin films Journal of Vacuum Science and Technology a: Vacuum, Surfaces and Films. 15: 936-940. DOI: 10.1116/1.580782 |
0.318 |
|
| 1996 |
Brenner DW, Shenderova O, Parker CB. Ion beam damage of polymer surfaces: insights from molecular-dynamics simulation Materials Research Society Symposium - Proceedings. 438: 491-498. DOI: 10.1557/Proc-438-491 |
0.361 |
|
| 1996 |
Barrett JJC, Robertson DH, Brenner DW, White CT. Simulations of ozone detonation using a reactive empirical bond order (REBO) potential for the oxygen system Materials Research Society Symposium - Proceedings. 418: 301-308. DOI: 10.1557/Proc-418-301 |
0.352 |
|
| 1996 |
Brenner DW, Sinnott SB, Harrison JA, Shenderova OA. Simulated engineering of nanostructures Nanotechnology. 7: 161-167. DOI: 10.1088/0957-4484/7/3/001 |
0.311 |
|
| 1995 |
Yu J, Omeltchenko A, Kalia RK, Vashishta P, Brenner DW. Large Scale Molecular Dynamics Study of Amorphous Carbon and Graphite on Parallel Machines Mrs Proceedings. 408. DOI: 10.1557/Proc-408-113 |
0.335 |
|
| 1995 |
Robertson DH, Brenner DW, White CT. Molecular dynamics simulations of hypervelocity buckminsterfullerene collisions Materials Research Society Symposium - Proceedings. 359: 199-204. DOI: 10.1557/Proc-359-198 |
0.309 |
|
| 1995 |
Robertson DH, Brenner DW, White CT. Temperature-dependent fusion of colliding C60 fullerenes from molecular dynamics simulations Journal of Physical Chemistry. 99: 15721-15724. DOI: 10.1021/J100043A006 |
0.302 |
|
| 1995 |
Harrison JA, White CT, Colton RJ, Brenner DW. Investigation of the atomic-scale friction and energy dissipation in diamond using molecular dynamics Thin Solid Films. 260: 205-211. DOI: 10.1016/0040-6090(94)06511-X |
0.343 |
|
| 1994 |
Robertson DH, Dunlap BI, Brenner DW, Mintmire JW, White CT. Fullerene/Tubule Based Hollow Carbon Nano-Gears Mrs Proceedings. 349: 283. DOI: 10.1557/Proc-349-283 |
0.325 |
|
| 1994 |
Harrison JA, Brenner DW. Simulated tribochemistry: An atomic-scale view of the wear of diamond Journal of the American Chemical Society. 116: 10399-10402. DOI: 10.1021/Ja00102A006 |
0.36 |
|
| 1994 |
Dunlap BI, Brenner DW, Schriver GW. Symmetric Isomers of Hydrofullerene C60H36 The Journal of Physical Chemistry. 98: 1756-1757. DOI: 10.1021/J100058A006 |
0.319 |
|
| 1994 |
Tupper KJ, Brenner DW. Molecular dynamics simulations of friction in self-assembled monolayers Thin Solid Films. 253: 185-189. DOI: 10.1016/0040-6090(94)90317-4 |
0.33 |
|
| 1994 |
Sinnott SB, Colton RJ, White CT, Brenner DW. Surface patterning by atomically-controlled chemical forces: molecular dynamics simulations Surface Science. 316. DOI: 10.1016/0039-6028(94)91122-3 |
0.337 |
|
| 1993 |
Brenner DW, Robertson DH, Elert ML, White CT. Detonations at nanometer resolution using molecular dynamics. Physical Review Letters. 70: 2174-2177. PMID 10053489 DOI: 10.1103/Physrevlett.70.2174 |
0.329 |
|
| 1993 |
Harrison JA, White CT, Colton RJ, Brenner DW. Atomistic simulations of friction at sliding diamond interfaces Mrs Bulletin. 18: 50-53. DOI: 10.1557/S0883769400047138 |
0.302 |
|
| 1993 |
Harrison JA, White CT, Colton RJ, Brenner DW. Effects of chemically-bound, flexible hydrocarbon species on the frictional properties of diamond surfaces Journal of Physical Chemistry. 97: 6573-6576. DOI: 10.1021/J100127A001 |
0.335 |
|
| 1993 |
Harrison JA, Colton RJ, White CT, Brenner DW. Effect of atomic-scale surface roughness on friction: A molecular dynamics study of diamond surfaces Wear. 168: 127-133. DOI: 10.1016/0043-1648(93)90208-4 |
0.304 |
|
| 1992 |
Robertson DH, Brenner DW, Mintmire JW. Energetics of nanoscale graphitic tubules. Physical Review. B, Condensed Matter. 45: 12592-12595. PMID 10001304 DOI: 10.1103/Physrevb.45.12592 |
0.338 |
|
| 1992 |
Brenner D, Robertson D, Carty R, Srivastava D, Garrison B. Combining Molecular Dynamics and Monte Carlo Simulations to Model Chemical Vapor Deposition: Application to Diamond Mrs Proceedings. 278. DOI: 10.1557/Proc-278-255 |
0.343 |
|
| 1992 |
Brenner D, Mowrey R, Mintmire JW, Harrison J, Robertson D, Lyons M, Dunlap B, White C. Theory for New Carbon-Based Materials Mrs Proceedings. 270. DOI: 10.1557/Proc-270-275 |
0.397 |
|
| 1992 |
Mintmire JW, Robertson DH, Dunlap BI, Mowrey RC, Brenner DW, White CT. Electronic Structure of Fullerene Tubules Mrs Proceedings. 247. DOI: 10.1557/Proc-247-339 |
0.314 |
|
| 1992 |
Robertson DH, Brenner DW, White CT. On the way to fullerenes: Molecular dynamics study of the curling and closure of graphitic ribbons Journal of Physical Chemistry. 96: 6133-6135. DOI: 10.1021/J100194A011 |
0.341 |
|
| 1992 |
White CT, Robertson DH, Brenner DW. Dissociative phase transitions from hypervelocity impacts Physica a: Statistical Mechanics and Its Applications. 188: 357-366. DOI: 10.1016/0378-4371(92)90280-4 |
0.305 |
|
| 1991 |
Harrison JA, Colton RJ, White CT, Brenner DW. Atomistic Simulation of the Nanoindentation of Diamond and Graphite Surfaces Mrs Proceedings. 239. DOI: 10.1557/Proc-239-573 |
0.342 |
|
| 1991 |
Page M, Brenner DW. Hydrogen abstraction from a diamond surface. Ab initio quantum chemical study with constrained isobutane as a model Journal of the American Chemical Society. 113: 3270-3274. DOI: 10.1021/Ja00009A008 |
0.338 |
|
| 1991 |
Dunlap BI, Brenner DW, Mintmire JW, Mowrey RC, White CT. Local Density Functional Electronic Structures of Three Stable Icosahedral Fullerenes The Journal of Physical Chemistry. 95: 8737-8741. DOI: 10.1021/J100175A058 |
0.313 |
|
| 1991 |
Mowrey RC, Brenner DW, Dunlap BI, Mintmire JW, White CT. Simulations of buckminsterfullerene (C60) collisions with a hydrogen-terminated diamond {111} surface The Journal of Physical Chemistry. 95: 7138-7142. DOI: 10.1021/J100172A011 |
0.337 |
|
| 1991 |
Harrison JA, Brenner DW, White CT, Colton RJ. Atomistic mechanisms of adhesion and compression of diamond surfaces Thin Solid Films. 206: 213-219. DOI: 10.1016/0040-6090(91)90424-V |
0.302 |
|
| 1990 |
Dunlap BI, Brenner DW, Mowrey RC, Mintmire JW, White CT. Linear combination of Gaussian-type orbitals-local-density-functional cluster studies of D-D interactions in titanium and palladium. Physical Review. B, Condensed Matter. 41: 9683-9687. PMID 9993340 DOI: 10.1103/Physrevb.41.9683 |
0.308 |
|
| 1990 |
Mintmire JW, Mowrey RC, Brenner DW, Dunlap BI, White CT. First-Principles Study of Photoexcited Defects in Polysilane Chains Mrs Proceedings. 209. DOI: 10.1557/Proc-209-189 |
0.328 |
|
| 1990 |
Dunlap BI, Brenner DW, Mowrey RC, Mintmire JW, Robertson DH, White CT. Possidle Isomers and Electronic Structure of C60H36 Mrs Proceedings. 206. DOI: 10.1557/Proc-206-687 |
0.321 |
|
| 1990 |
Mowrey R, Brenner D, Dunlap B, Mintmire J, White C. Molecular-Dynamics Simulations of Collisions of Buckminsterfullerene with Diamond Surfaces Mrs Proceedings. 206. DOI: 10.1557/Proc-206-357 |
0.353 |
|
| 1990 |
Brenner DW. Empirical potential for hydrocarbons for use in simulating the chemical vapor deposition of diamond films Physical Review B. 42: 9458-9471. DOI: 10.1103/Physrevb.42.9458 |
0.364 |
|
| 1990 |
Brenner DW. Atomistic computer simulations of the reactive dynamics of diamond surfaces Carbon. 28: 769-770. DOI: 10.1016/0008-6223(90)90281-3 |
0.314 |
|
| 1990 |
White CT, Dunlap BI, Brenner DW, Mowrey RC, Mintmire JW. Limits of chemical effects on cold fusion Journal of Fusion Energy. 9: 363-366. DOI: 10.1007/Bf01059258 |
0.304 |
|
| 1988 |
Brenner DW. Tersoff-Type Potentials for Carbon, Hydrogen and Oxygen Mrs Proceedings. 141: 59. DOI: 10.1557/Proc-141-59 |
0.337 |
|
| 1988 |
Garrison BJ, Miller MT, Brenner D. Mechanisms of Molecular Beam Epitaxial Growth on Reconstructed Si{100}: Thermal and Energized Beams Mrs Proceedings. 141. DOI: 10.1557/Proc-141-419 |
0.33 |
|
| 1988 |
Brenner DW, Garrison BJ. Microscopic mechanisms of reactions associated with silicon MBE: A molecular dynamics investigation Surface Science. 198: 151-166. DOI: 10.1016/0039-6028(88)90477-3 |
0.32 |
|
| 1987 |
Brenner DW, Garrison BJ. Molecular Dynamics Studies of the Adatom Induced Rearrangement of the Silicon {100} Surface Mrs Proceedings. 94. DOI: 10.1557/Proc-94-77 |
0.318 |
|
| 1986 |
Brenner DW, Garrison BJ. Dissociative valence force field potential for silicon Physical Review B. 34: 1304-1307. DOI: 10.1103/Physrevb.34.1304 |
0.316 |
|
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