Journal Article
Garrison JR, Mishmash RV, Fisher MPA.  2017.  Partial breakdown of quantum thermalization in a Hubbard-like model. Phys. Rev. B. 95:054204.
Hoang K., Janotti A., Van de Walle C.G.  2011.  The Particle-Size Dependence of the Activation Energy for Decomposition of Lithium Amide.. Angewandte Chemie International Edition. -:inpress.
Tang X, Alabduljalil M, Jin X, Yang T.  2017.  Partitioned Similarity Search with Cache-Conscious Data Traversal. ACM Transactions on Knowledge Discovery from Data (TKDD). 11:34.
Kalantari NKhademi, Shechtman E, Barnes C, Darabi S, Goldman DB, Sen P.  2013.  Patch-Based High Dynamic Range Video. ACM Transactions on Graphics (TOG). 32:202.
Janotti A, Snow E, Van de Walle CG.  2009.  A pathway to p-type wide-band-gap semiconductors. Appl. Phys. Lett.. 95:172109.
Van de Walle CG.  2018.  PCCP. Phys. Chem. Chem. Phys. 20:12373–12380.
Gibou F, Min C.  2012.  On the performance of a simple parallel implementation of the ILU-PCG for the Poisson equation on irregular domains. Journal of Computational Physics. 231:4531.
O’Sullivan M.E., Brevik J., Wolski R..  2005.  The Performance of LDPC codes with Large Girth. Proc. 43rd Allerton Conference on Communication. Control and Computing:Univ.Illinois,Aug..
Khanna V, Monroe JI, Doherty MF, Peters B.  2020.  Performing solvation free energy calculations in LAMMPS using the decoupling approach. Journal of Computer-Aided Molecular Design. :1–6.
Ceniceros HD, Fisher JE.  2012.  Peristaltic pumping of a viscoelastic fluid at high occlusion ratios and large Weissenberg numbers. Journal of Non-Newtonian Fluid Mechanics. 171-172:31-41.
Goiri JGabriel, Van der Ven A.  2016.  Phase and structural stability in Ni-Al systems from first principles. Physical Review B. 94(9):14.
Audus DJ, Gopez JD, Krogstad DV, Lynd NA, Kramer EJ, Hawker CJ, Fredrickson GH.  2015.  Phase behavior of electrostatically complexed polyelectrolyte gels using an embedded fluctuation model. Soft Matter. 11:1214-1225.
Mester Z, Lynd NA, Delaney KT, Fredrickson GH.  2014.  Phase Coexistence Calculations of Reversibly Bonded Block Copolymers: A Unit Cell Gibbs Ensemble Approach. Macromolecules.
Pan L, Zhang D, Hung H-H, Liu Y-J.  2017.  Phase diagram of the frustrated asymmetric ferromagnetic spin ladder. The European Physical Journal B. 90:105.
Douglas JE, Birkel CS, Verma N, Miller VM, Miao M-S, Stucky GD, Pollock TM, Seshadri R.  2014.   Phase stability and property evolution of biphasic Ti–Ni–Sn alloys for use in thermoelectric applications. Journal of Applied Physics. 115:043720–043720.
Wang W, Janotti A, Van de Walle CG.  2017.  Phase transformations upon doping in WO3. The Journal of Chemical Physics. 146:214504.
Xu S, Mianroodi JR, Hunter A, Beyerlein IJ, Svendsen B.  2019.  Phase-field-based calculations of the disregistry fields of static extended dislocations in FCC metals. Philosophical Magazine. 99:1400–1428.
Noffsinger J., Kioupakis E., Van de Walle C.G., Louie S.G, Cohen M.L.  2012.  Phonon-Assisted Optical Absorption in Silicon from First Principles. Phys. Rev. Lett.. 108:167402.
Estrada Z.J., Dellabetta B., Ravaioli U., Gilbert M.J..  2012.  Phonon-Limited Transport in Graphene Pseudospintronic Devices. Electron Device Letters, IEEE. 33:1465-1467.
Naughton HR, Alexandrou MA, Oakley TH, Cardinale BJ.  2015.  Phylogenetic distance does not predict competition in green algal communities. Ecosphere. 6:art116.
Oakley TH, Wolfe JM, Lindgren AR, Zaharoff AK.  2013.  Phylotranscriptomics to Bring the Understudied into the Fold: Monophyletic Ostracoda, Fossil Placement and Pancrustacean Phylogeny. Molecular Biology and Evolution. 30(1):215.
Bjaalie L, Janotti A, Krishnaswamy K, Van de Walle CG.  2016.  Point defects, impurities, and small hole polarons in GdTiO 3. Physical Review B. 93:115316.
Weber J.R., Janotti A., Van de Walle C.G..  2009.  Point defects in Al2O3 and their impact on gate stacks. Microelectronic Engineering. 86:1756.
Weber J.R., Janotti A., Van de Walle C.G..  2009.  Point defects in Al2O3 and their impact on gate stacks. Microelectronic Engineering. 86:1756.
Delaney KT, Fredrickson GH.  2013.  Polymer Field-Theory Simulations on Graphics Processing Units. Comp Phys Comm. (in press)