Publications

Google Scholar Profile

2009 2011 2013  2014  2015  2016  2017 2018 2019 2020 2021 2022


​2022

     
  1.   Hussain S., Haji-Akbari A. How to quantify and avoid finite size effects in computational studies of crystal nucleation: The case of homogeneous crystal nucleation.  J. Chem. Phys.  2022, 156: 054503 .
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      ​2021

         
      1.   Hussain S., Haji-Akbari A. Role of nanoscale interfacial proximity in contact freezing in water. J. Am. Chem. Soc..  2021, 143: 2272–2284 .
          2.  
        1.   Hussain S., Haji-Akbari A. How to quantify and avoid finite size effects in computational studies of crystal nucleation: The case of heterogeneous ice nucleation. J. Chem. Phys.  2021, 154: 014108 .
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            ​2020

               
            1.   Hussain S., Haji-Akbari A. Studying rare events using forward-flux sampling: Recent breakthroughs and future outlook. J. Chem. Phys.  2020, 152: 060901 .
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              1.   Malmir H., Epsztein R., Elimelech M., Haji-Akbari A. Induced Charge Anisotropy: A Hidden Variable Affecting Ion Transport through Membranes. Matter  2020, 2: 735-750 .

                  2. ​2019
                     
                  1.   Feng X, Kawabata K, Cowan M G, Dwulet G E, Toth K, Sixdenier L, Haji-Akbari A, Noble R D, Elimelech M, Gin D L and Osuji C O Single crystal texture by directed molecular self-assembly along dual axes. Nat. Mater.  2019, 18: 1235-1243 .
                      2.  
                    1.  Falahati H, Haji-Akbari, A. Thermodynamically Driven Assemblies and Liquid-liquid Phase Separations in Biology. Soft Matter  2019, 15: 1135, [Invited Article, Special Issue Soft Matter Emerging Investigators ].
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                        ​2018

                      1.  Haji-Akbari, A. Forward-flux sampling with jumpy order parameters. J. Chem. Phys.  2018, 149: 072303, [Invited Article, Special Topic on Enhanced Sampling for Molecular Systems ].
                          2.  
                        1.  Palmer, J. C. ;  Haji-Akbari, A. ;;  Singh, R. S. ;  Martelli, F. ;  Car, R. ;  Panagiotopoulos, A. Z. ; Debenedetti, P. G. Comment on “The putative liquid-liquid transition is a liquid-solid transition in atomistic models of water” [I and II: J. Chem. Phys. 135, 134503 (2011); J. Chem. Phys. 138, 214504 (2013)]. J. Chem. Phys.  2018, 148: 137101.
                            2.  
                          1.  Guo, J ; Haji-Akbari,, A. ;  Palmer, J. C. .Hybrid Monte Carlo with LAMMPS.  J. Theor. Comput. Chem.  2018, 17: 1840002.
                              2.  
                            1.  Jiang H. ; Haji-Akbari, A. ;  Debenedetti, P. G. ;  Panagiotopoulos, A. Z .Forward flux sampling calculation of homogeneous nucleation rates from aqueous NaCl solutions. J. Chem. Phys.  2018, 148: 044505.

                                2. ​2017
                                   
                                1.  Haji-Akbari, A. ; Debenedetti, P. G. Perspective: Surface freezing in water: A nexus of experiments and simulations. J. Chem. Phys.  2017, 147: 060901. [Invited]
                                    2.  
                                  1.  Zheng, S. ;  Fogler, H. S. ; Haji-Akbari, A.  A Fundamental Wax Deposition Model for Water-in-Oil Dispersed Flows in Subsea Pipelines. AIChE J. 2017, 63: 4201-4213.
                                      2.  
                                    1.  Haji-Akbari, A. ; Debenedetti, P. G. Computational Investigation of Surface Freezing in a Molecular Model of Water. Proc. Natl. Acad. Sci. USA 2017, 114: 3316–3321.
                                        2.  
                                      1.  Altabet, Y. E. ; Haji-Akbari, A. ; Debenedetti, P. G. Effect of Material Flexibility on the Thermodynamics and Kinetics of Hydrophobically-Induced Evaporation of Water. Proc. Natl. Acad. Sci. USA 2017, 114: E2548–E2555.


                                        2. ​2016

                                        1.  Haji-Akbari, A. Rating antifreeze proteins: Not a breeze. Proceedings of the National Academy of Sciences  2016, 113, 3714-3716. [Invited]] 
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                                        2.  Gianetti, M. M. ; Haji-Akbari, A. ; Longinotti, P. M. ; Debenedetti, P. G. Computational investigation of structure, dynamics and nucleation kinetics of a family of modified Stillinger-Weber model fluids in bulk and free-standing thin films. Physical Chemistry Chemical Physics 2016, 18, 4102--4111.
                                         


                                        ​2015

                                        1.  Haji-Akbari, A. ; Debenedetti, P. G. Thermodynamic and Kinetic Anisotropies in Octane Thin Films. Journal of Chemical Physics  2015, 143, 214501.2014.
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                                        2.  Haji-Akbari, A. ; Glotzer, S. C. Strong Orientational Coordinates and Orientational Order Parameters for Symmetric Objects. Journal of Physics A: Mathematical and Theoretical  2015, 48, 485201.
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                                        3.  Haji-Akbari, A. ; Haji-Akbari, N. ; Ziff, R. M. Dimer Covering and Percolation Frustration. Physical Review E 2015, 92, 032134.
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                                        4.  Haji-Akbari, A. ; Debenedetti, P. G.,Direct Calculation of Ice Homogeneous Nucleation Rate for a Molecular Model of Water. Proceedings of the National Academy of Sciences 2015, 112, 10582-10588.
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                                        ​2014

                                        1. Haji-Akbari, A. ; DeFever, R. S. ; Sarupria, S. ; Debenedetti, P. G. Suppression of Subsurface Freezing in Free-standing Thin Films of Monoatomic Water. Physical Chemistry Chemical Physics 2014, 16, 25916-25927.
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                                        2.  Haji-Akbari, A. ; Debenedetti, P. G. The Effect of Substrate on Thermodynamic and Kinetic Anisotropies in Atomic Thin Films. Journal of Chemical Physics 2014, 141, 024506.
                                         


                                        ​2013

                                        1. Haji-Akbari, A. ; Chen, E. R. ; Engel, M. ; Glotzer, S. C. Packing and self-assembly of truncated triangular bipyramids. Physical Review E 2013, 88, 012127.
                                         


                                        ​2011

                                        1. Haji-Akbari, A. ; Engel, M. ; Glotzer, S. C. Degenerate Quasicrystal of Hard Triangular Bipyramids. Physical Review Letters 2011, 107, 215702.
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                                        2. Haji-Akbari, A. ; Engel, M. ; Glotzer, S. C. Phase diagram of hard tetrahedra. Journal of Chemical Physics 2011, 135, 194101.


                                        ​2009

                                        1. Haji-Akbari, A. ; Engel, M. ; Keys, A. S. ; Zheng, X. ; Petschek, R. G. ; Palffy-Muhoray, P. ; Glotzer, S. C. Disordered, quasicrystalline and crystalline phases of densely packed tetrahedra. Nature 2009, 462, 773-777.
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                                        2. Haji-Akbari, A. ; Ziff, R. M. Percolation in networks with voids and bottlenecks. Physical Review E 2009, 79, 021118.