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Murray S. Daw - Publications

Affiliations: 
Physics Clemson University, Clemson, SC, United States 
Area:
Condensed Matter Physics
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59 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
2020 Dickel D, Daw MS. Calculation of mode lifetimes in weakly anharmonic solids using self-consistent ensemble eigenstates of the Liouvillian Computational Materials Science. 185: 109918. DOI: 10.1016/J.Commatsci.2020.109918  0.349
2019 Wright AF, Daw MS, Fong CY. Structures and energetics of Pt, Pd, and Ni adatom clusters on the Pt(001) surface: Embedded-atom-method calculations. Physical Review. B, Condensed Matter. 42: 9409-9419. PMID 9995180 DOI: 10.1103/Physrevb.42.9409  0.321
2019 Dickel D, Daw MS. First-principles electronic structure in second-moment calculation of mode frequencies: Failure of quasiharmonic approximation in silicon Physical Review B. 100. DOI: 10.1103/Physrevb.100.214314  0.3
2015 Gao Y, Wang H, Daw MS. Calculations of lattice vibrational mode lifetimes using Jazz: a Python wrapper for LAMMPS Modelling and Simulation in Materials Science and Engineering. 23: 45002. DOI: 10.1088/0965-0393/23/4/045002  0.304
2014 Gao Y, Daw MS. Testing the fourth moment approximation of vibrational mode lifetimes in fcc Lennard-Jonesium Modelling and Simulation in Materials Science and Engineering. 22: 75011. DOI: 10.1088/0965-0393/22/7/075011  0.305
2014 Gao Y, Dickel D, Harrison D, Daw MS. Improved calculation of vibrational mode lifetimes in anharmonic solids – Part III: Extension to fourth moment Computational Materials Science. 89: 12-18. DOI: 10.1016/J.Commatsci.2014.03.026  0.314
2012 Lawson JW, Daw MS, Squire TH, Bauschlicher CW. Computational Modeling of Grain Boundaries in ZrB2: Implications for Lattice Thermal Conductivity Journal of the American Ceramic Society. 95: 3971-3978. DOI: 10.1111/Jace.12037  0.33
2011 Lawson JW, Bauschlicher CW, Daw MS. Ab Initio Computations of Electronic, Mechanical, and Thermal Properties of ZrB2 and HfB2 Journal of the American Ceramic Society. 94: 3494-3499. DOI: 10.1111/J.1551-2916.2011.04649.X  0.332
2010 Dickel D, Daw MS. Improved calculation of vibrational mode lifetimes in anharmonic solids – Part II: Numerical results Computational Materials Science. 49: 445-449. DOI: 10.1016/J.Commatsci.2010.04.039  0.355
2010 Dickel D, Daw MS. Improved calculation of vibrational mode lifetimes in anharmonic solids—Part I: Theory Computational Materials Science. 47: 698-704. DOI: 10.1016/J.Commatsci.2009.10.011  0.314
2009 Gao X, Daw MS. First-principles super-cell investigation of the rattling effect in Li-doped KCl. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 21: 045401. PMID 21715802 DOI: 10.1088/0953-8984/21/4/045401  0.379
2008 Gao X, Daw MS. Investigation of band inversion in (Pb,Sn)Te alloys using ab initio calculations Physical Review B. 77: 33103. DOI: 10.1103/Physrevb.77.033103  0.343
2008 Bleda EA, Gao X, Daw MS. Calculations of diffusion in FCC binary alloys using on-the-fly kinetic Monte Carlo Computational Materials Science. 43: 608-615. DOI: 10.1016/J.Commatsci.2008.01.001  0.692
2006 Daw MS. Elasticity effects in electronic structure calculations with periodic boundary conditions Computational Materials Science. 38: 293-297. DOI: 10.1016/J.Commatsci.2006.02.009  0.32
2003 Srinivasan R, Daw MS, Noebe RD, Mills MJ. Observations of glide and decomposition of a dislocations at high temperatures in Ni-Al single crystals deformed along the hard orientation Philosophical Magazine. 83: 1111-1135. DOI: 10.1080/0141861021000047140  0.307
2001 Laudon M, Carlson NN, Masquelier MP, Daw MS, Windl W. Multiscale modeling of stress-mediated diffusion in silicon: Ab initio to continuum Applied Physics Letters. 78: 201-203. DOI: 10.1063/1.1336158  0.316
1999 Mills MJ, Viswanathan GB, Srinivasan R, Savage MF, Noebe RD, Daw MS. Dislocation Structure and Deformation Behavior of Intermetallic Compounds Mrs Proceedings. 578. DOI: 10.1557/Proc-578-169  0.312
1998 Mills MJ, Srinivasan R, Daw MS. Observations and modelling of a dislocations in NiAl at intermediate temperatures Philosophical Magazine. 77: 801-823. DOI: 10.1080/01418619808224085  0.39
1998 Srinivasan R, Savage MF, Daw MS, Noebe RD, Mills MJ. Decomposition of a〈111〉 and a〈101〉 dislocations in hard-oriented NiAl single crystals Scripta Materialia. 39: 457-464. DOI: 10.1016/S1359-6462(98)00222-X  0.327
1996 Srinivasan R, Savage MF, Daw MS, Noebe RD, Mills MJ. Slip transition and dislocation structures in off-stoichiometric NiAl single crystals Mrs Proceedings. 460: 505. DOI: 10.1557/Proc-460-505  0.304
1995 Fallis MC, Daw MS, Fong CY. Energetics of small Pt clusters on Pt(111): Embedded-atom-method calculations and phenomenology. Physical Review. B, Condensed Matter. 51: 7817-7826. PMID 9977365 DOI: 10.1103/Physrevb.51.7817  0.338
1995 Mills MJ, Angelo JE, Daw MS, Weinburg JD, Miracle DB. Fine structure of a〈011〉 dislocations and the mechanical properties of NiAl in the hard orientation Materials Science and Engineering a-Structural Materials Properties Microstructure and Processing. 134-141. DOI: 10.1016/0921-5093(94)03227-0  0.327
1994 Chrzan DC, Foiles SM, Daw MS, Mills MJ. Temperature-Dependent Structure of a<101> Superdislocations in Ni3Al Mrs Proceedings. 364. DOI: 10.1557/Proc-364-731  0.379
1994 Rice BM, Garrett BC, Koszykowski ML, Foiles SM, Daw MS. Erratum: Kinetic isotope effects for hydrogen diffusion in bulk nickel and on nickel surfaces [J. Chem. Phys. 92, 775 (1990)] Journal of Chemical Physics. 100: 8556-8556. DOI: 10.1063/1.467289  0.305
1994 Mills MJ, Daw MS, Foiles SM. High-resolution transmission electron microscopy studies of dislocation cores in metals and intermetallic compounds Ultramicroscopy. 56: 79-93. DOI: 10.1016/0304-3991(94)90148-1  0.341
1994 Fallis MC, Wright AF, Fong CY, Daw MS. Trapping of a diffusing adatom by a substitutional surface defect Surface Science. 311. DOI: 10.1016/0039-6028(94)91415-X  0.36
1993 Daw MS. Model for energetics of solids based on the density matrix. Physical Review B. 47: 10895-10898. PMID 10005211 DOI: 10.1103/Physrevb.47.10895  0.312
1993 Daw MS, Foiles SM, Baskes MI. The embedded-atom method: a review of theory and applications Materials Science Reports. 9: 251-310. DOI: 10.1016/0920-2307(93)90001-U  0.354
1992 Medlin DL, Mills MJ, Stobbs WM, Daw MS, Cosandey F. Hrtem Observations Of A Σ=3 {112} Bicrystal Boundary In Aluminum Mrs Proceedings. 295: 91. DOI: 10.1557/Proc-295-91  0.328
1992 Mills MJ, Daw MS, Foiles SM, Miracle DB. Hrtem Observation and EAM Calculation of Dislocation Cores in Nial Mrs Proceedings. 288: 257. DOI: 10.1557/Proc-288-257  0.342
1992 Phillips R, Deng H, Carlsson AE, Daw MS. Improvement of six-dimensional projection models for the atomic structure of quasicrystals Physical Review B. 45: 7463-7466. DOI: 10.1103/Physrevb.45.7463  0.352
1992 Mills MJ, Daw MS, Thomas GJ, Cosandey F. High-resolution transmission electron microscopy of grain boundaries in aluminum and correlation with atomistic calculations Ultramicroscopy. 40: 247-257. DOI: 10.1016/0304-3991(92)90121-Y  0.361
1991 Phillips R, Deng H, Carlsson AE, Daw MS. Total energies of improved quasicrystal models Physical Review Letters. 67: 3128-3131. DOI: 10.1103/Physrevlett.67.3128  0.302
1990 Foiles SM, Daw MS, Phillips RB. Tilt Boundaries In BCC Metals:Comparison of Results Using Different Interatomic Interactions Mrs Proceedings. 209: 65. DOI: 10.1557/Proc-209-65  0.361
1990 Dahmen U, Hetheringtont CJD, O'Keefe MA, Westmacottt KH, Mills MJ, Daw MS, Vitek V. Atomic structure of a Σ99 grain boundary in aluminium: A comparison between atomic-resolution observation and pair-potential and embedded-atom simulations Philosophical Magazine Letters. 62: 327-335. DOI: 10.1080/09500839008215153  0.373
1990 Rice BM, Garrett BC, Koszykowski ML, Foiles SM, Daw MS. Kinetic isotope effects for hydrogen diffusion in bulk nickel and on nickel surfaces Journal of Chemical Physics. 92: 775-791. DOI: 10.1063/1.458381  0.369
1990 Nelson JS, Daw MS, Sowa EC. Embedded atom calculations of the Cu (001), (111), and (110) surface phonon spectra Superlattices and Microstructures. 7: 259-267. DOI: 10.1016/0749-6036(90)90304-P  0.382
1990 Roelofs LD, Foiles SM, Daw MS, Baskes M. The (1 × 2) missing-row phase of Au(110): energetics determined from an extended embedded atom method Surface Science. 234: 63-71. DOI: 10.1016/0039-6028(90)90665-U  0.369
1990 Einstein TL, Daw MS, Foiles SM. Indirect interactions of H/Ni(111) and H/Pd(100) using embedded atom method Surface Science. 227: 114-122. DOI: 10.1016/0039-6028(90)90398-R  0.328
1989 Daw MS. Model of metallic cohesion: The embedded-atom method. Physical Review B. 39: 7441-7452. PMID 9947422 DOI: 10.1103/Physrevb.39.7441  0.397
1989 Mills MJ, Thomas GJ, Daw MS, Cosandey F. Structure of a Near-Coincidence Σ9 Tilt Grain Boundary in Aluminum Mrs Proceedings. 159. DOI: 10.1557/Proc-159-365  0.342
1989 Nelson JS, Daw MS, Sowa EC. Cu(111) and Ag(111) surface-phonon spectrum: The importance of avoided crossings Physical Review B. 40: 1465-1480. DOI: 10.1103/Physrevb.40.1465  0.379
1988 Foiles SM, Daw MS. Calculation of the thermal expansion of metals using the embedded-atom method Physical Review B. 38: 12643-12644. PMID 9946211 DOI: 10.1103/Physrevb.38.12643  0.371
1988 Baskes MI, Daw MS, Foiles SM. The Embedded Atom Method: Theory and Application Mrs Proceedings. 141. DOI: 10.1557/Proc-141-31  0.307
1988 Foiles SM, Baskes MI, Daw MS. Atomistic Studies of Interfacial Structure and Properties Mrs Proceedings. 122: 343. DOI: 10.1557/Proc-122-343  0.403
1988 Nelson JS, Sowa EC, Daw MS. Calculation of phonons on the Cu(100) surface by the embedded-atom method Physical Review Letters. 61: 1977-1980. DOI: 10.1103/Physrevlett.61.1977  0.399
1987 Daw MS, Foiles SM. Order-disorder transition of Au and Pt(110) surfaces: The significance of relaxations and vibrations. Physical Review Letters. 59: 2756-2759. PMID 10035640 DOI: 10.1103/Physrevlett.59.2756  0.32
1987 Foiles SM, Daw MS. Application of the embedded atom method to Ni 3 Al Journal of Materials Research. 2: 5-15. DOI: 10.1557/Jmr.1987.0005  0.405
1987 Foiles SM, Baskes MI, Melius CF, Daw MS. Calculation of hydrogen dissociation pathways on nickel using the embedded atom method Journal of the Less Common Metals. 130: 465-473. DOI: 10.1016/0022-5088(87)90144-5  0.391
1986 Foiles SM, Baskes MI, Daw MS. Embedded-atom-method functions for the fcc metals Cu, Ag, Au, Ni, Pd, Pt, and their alloys. Physical Review B. 33: 7983-7991. PMID 9938188 DOI: 10.1103/Physrevb.33.7983  0.39
1986 Daw MS, Foiles SM. Summary Abstract: Calculations of the energetics and structure of Pt(110) using the embedded atom method Journal of Vacuum Science and Technology. 4: 1412-1413. DOI: 10.1116/1.573585  0.362
1986 Felter TE, Foiles SM, Daw MS, Stulen RH. Order-disorder transitions and subsurface occupation for hydrogen on Pd(111) Surface Science. 171. DOI: 10.1016/0167-2584(86)91202-8  0.348
1986 Daw MS. Calculations of the energetics and structure of Pt(110) reconstruction using the embedded atom method Surface Science Letters. 166. DOI: 10.1016/0167-2584(86)90917-5  0.367
1986 Daw MS. Surface science lettersCalculations of the energetics and structure of Pt(110) reconstruction using the embedded atom method Surface Science. 166. DOI: 10.1016/0039-6028(86)90678-3  0.362
1985 Daw MS, Hatcher RD. Application of the embedded atom method to phonons in transition metals Solid State Communications. 56: 697-699. DOI: 10.1016/0038-1098(85)90781-1  0.384
1984 Daw MS, Baskes MI. Embedded-atom method: Derivation and application to impurities, surfaces, and other defects in metals Physical Review B. 29: 6443-6453. DOI: 10.1103/Physrevb.29.6443  0.382
1983 Daw MS, Bisson CL, Wilson WD. Hydrogen binding to fixed interstitial impurities in metals Solid State Communications. 46: 735-738. DOI: 10.1016/0038-1098(83)90215-6  0.321
1983 Daw MS, Bisson CL, Wilson WD. Calculations of the binding of hydrogen to fixed interstitial impurities in nickel Metallurgical and Materials Transactions a-Physical Metallurgy and Materials Science. 14: 1257-1260. DOI: 10.1007/Bf02664807  0.35
1980 Daw MS, Smith DL. Surface vacancies in InP and GaAlAs Applied Physics Letters. 36: 690-692. DOI: 10.1063/1.91594  0.338
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