A. Bilić

发表

Enhancing the efficiency of solution-processable bulk-heterojunction devices via a three-dimensional molecular architecture comprising triphenylamine and cyanopyridone

Rahul V. Hangarge, Sheshanath V. Bhosale, D. La, 2017 .

Small molecules containing rigidified thiophenes and a cyanopyridone acceptor unit for solution-processable bulk-heterojunction solar cells

U. Bach, R. Evans, Mei Gao, 2015 .

Symmetrical and unsymmetrical donor–acceptor–donor organic dyes: Design, synthesis and characterization. Engineering panchromic absorbance

R. Evans, Akhil Gupta, T. Singh, 2014 .

Machine learning and genetic algorithm prediction of energy differences between electronic calculations of graphene nanoflakes

A. Barnard, Michael Fernández, A. Bilić, 2017, Nanotechnology.

Chemisorbed and Physisorbed Structures for 1,10-Phenanthroline and Dipyrido(3,2-a:2',3'-c)phenazine on Au(111)

J. Reimers, Wenrong Yang, H. Wackerbarth, 2007 .

Modeling the adsorption of norbornadiene on the Si(001) surface: The predominance of non-[2+2]-cycloaddition products

N. Hush, J. Reimers, A. Bilić, 2003 .

Oxygen diffusion in the Ti3X alloys with elements from the IIIA or IVA groups and stability of their DO19 crystal structure

M. Gibson, K. McGregor, N. Wilson, 2017 .

Chemically Altering the Solubility and Durability of Dyes for Sensitized Solar Cells.

A. Holmes, G. Leeke, G. E. Collis, 2015, Organic letters.

Anomalous length dependence of the conductance of graphene nanoribbons with zigzag edges.

S. Sanvito, A. Bilić, 2013, The Journal of chemical physics.

Conductance of a phenylene-vinylene molecular wire: Contact gap and tilt angle dependence

J. Gale, S. Sanvito, I. Rungger, 2010 .

Donor-acceptor-acceptor-based non-fullerene acceptors comprising terminal chromen-2-one functionality for efficient bulk-heterojunction devices

S. Bhosale, W. Xiang, R. Evans, 2017 .

A non-fullerene electron acceptor based on central carbazole and terminal diketopyrrolopyrrole functionalities for efficient, reproducible and solution-processable bulk-heterojunction devices

Hemlata Patil, Akhil Gupta, A. Raynor, 2016 .

Naphthalene diimide-based non-fullerene acceptors for simple, efficient, and solution-processable bulk-heterojunction devices

S. Bhosale, Akhil Gupta, A. Raynor, 2016 .

Aggregation of a dibenzo[b,def]chrysene based organic photovoltaic material in solution.

A. Bond, A. Nafady, A. D. Scully, 2014, The journal of physical chemistry. B.

An H-shaped, small molecular non-fullerene acceptor for efficient organic solar cells with an impressive open-circuit voltage of 1.17 V

A. Rananaware, S. Bhosale, D. La, 2017 .

Two-Dimensional Boron Hydride Sheets: High Stability, Massless Dirac Fermions, and Excellent Mechanical Properties.

J. Bell, A. Du, A. Bilić, 2016, Angewandte Chemie.

Cyanopyridone flanked the tetraphenylethylene to generate an efficient, three-dimensional small molecule non-fullerene electron acceptor

A. Rananaware, D. La, W. Xiang, 2017 .

The impact of tetrahedral capping groups and device processing conditions on the crystal packing, thin film features and OFET hole mobility of 7,14-bis(ethynyl)dibenzo[b,def]chrysenes

C. McNeill, M. Bown, L. Thomsen, 2013 .

Multiphonon He atom scattering from Xe overlayers on Cu(111) and Cu(001) surfaces

M. Bertino, A. Graham, C. Wöll, 1997 .

Graphene-like Two-Dimensional Ionic Boron with Double Dirac Cones at Ambient Condition.

A. Du, Yuantong Gu, Zhongfang Chen, 2016, Nano letters.

The Green's function density functional tight-binding (gDFTB) method for molecular electronic conduction.

N. Hush, J. Reimers, A. Gagliardi, 2007, The journal of physical chemistry. A.

Prediction of novel alloy phases of Al with Sc or Ta

Ante Bilić, Julian D. Gale, Mark A. Gibson, 2015, Scientific Reports.

Reinvestigation of the surface reconstruction of Cu(001)-(2 × 2)p4g-Pd

B. King, D. J. O'connor, Yaogen Shen, 1997 .

N-Alkyl- and N-aryl-dithieno[3,2-b:2′,3′-d]pyrrole-containing organic dyes for efficient dye-sensitized solar cells

V. Armel, Akhil Gupta, A. Bilić, 2014 .

Front Cover: A Triphenylamine–Naphthalenediimide–Fullerene Triad: Synthesis, Photoinduced Charge Separation and Solution‐Processable Bulk Heterojunction Solar Cells (Asian J. Org. Chem. 1/2018)

R. Bhosale, K. Ohkubo, L. Jones, 2018 .

Ground state structure of BaZrO3: a comparative first-principles study

J. Gale, A. Bilić, 2009 .

An Azanorbornadiene Anchor For Molecular-Level Construction On Silicon(100)

N. Hush, J. Reimers, M. Hersam, 2004 .

Conformational transitions and dynamics of thermal responsive poly(N-isopropylacrylamide) polymers as revealed by molecular simulation

S. Thang, M. Liu, Cheryl Taylor, 2014 .

The nature of the adsorption of nucleobases on the gold [111] surface.

S. Piana, A. Bilić, 2006, The journal of physical chemistry. B.

An Electron-Accepting Chromophore Based on Fluorene and Naphthalenediimide Building Blocks for Solution-Processable Bulk Heterojunction Devices

Hemlata Patil, L. Jones, S. Bhosale, 2015 .

The structure, energetics, and nature of the chemical bonding of phenylthiol adsorbed on the Au(111) surface: implications for density-functional calculations of molecular-electronic conduction.

N. Hush, J. Reimers, A. Bilić, 2005, The Journal of chemical physics.

The Appropriateness of Density‐Functional Theory for the Calculation of Molecular Electronics Properties

N. Hush, J. Reimers, Zheng-Li Cai, 2003, Annals of the New York Academy of Sciences.

Constructive interference effects in energy loss spectra of energetic noble gas ions and atoms incident at glancing incidence to metal surfaces

B. Gumhalter, A. Bilić, K. Snowdon, 1994 .

What determines the sticking probability of water molecules on ice?

B. D. Kay, H. Jónsson, E. Batista, 2005, Physical review letters.

Coexistence of multiple conformations in cysteamine monolayers on Au(111).

N. Hush, J. Reimers, J. Ulstrup, 2005, The journal of physical chemistry. B.

A solution-processable electron acceptor based on diketopyrrolopyrrole and naphthalenediimide motifs for organic solar cells

Hemlata Patil, S. Bhosale, Akhil Gupta, 2014 .

Tailoring highly conductive graphene nanoribbons from small polycyclic aromatic hydrocarbons: a computational study

S. Sanvito, A. Bilić, 2013, Journal of physics. Condensed matter : an Institute of Physics journal.

Indan-1,3-dione electron-acceptor small molecules for solution-processable solar cells: a structure-property correlation.

Ying Shu, C. Forsyth, F. H. Scholes, 2013, Chemical communications.

Molecular Electronics: From Basic Chemical Principles to Photosynthesis to Steady-State Through-Molecule Conductivity to Computer Architectures

N. Hush, J. Reimers, M. Crossley, 2004 .

Adsorption of ammonia on the gold (111) surface

N. Hush, J. Reimers, J. Hafner, 2002 .

Adsorption sites of maleic anhydride on Si(1 0 0) revisited: inter- versus intra-row attachment

N. Hush, W. Hofer, J. Reimers, 2004 .

Adsorption of Benzene on Copper, Silver, and Gold Surfaces.

Ante Bilić, Jeffrey R Reimers, Noel S Hush, 2006, Journal of chemical theory and computation.

Adsorption of Pyridine on the Gold(111) Surface: Implications for “Alligator Clips” for Molecular Wires

N. Hush, J. Reimers, A. Bilić, 2002 .

Chemisorption of Molecular Hydrogen on Carbon Nanotubes: A Route to Effective Hydrogen Storage?

J. Gale, A. Bilić, 2008 .

Conjoint use of Dibenzosilole and Indan‐1,3‐dione Functionalities to Prepare an Efficient Non‐Fullerene Acceptor for Solution‐Processable Bulk‐Heterojunction Solar Cells

Hemlata Patil, P. Sonar, Akhil Gupta, 2015 .

Predicting a new phase (T'') of two-dimensional transition metal di-chalcogenides and strain-controlled topological phase transition.

A. Du, Haijun Zhang, Zhongfang Chen, 2016, Nanoscale.

Direct connection of an amine to oligothiophene to generate push-pull chromophores for organic photovoltaic applications

Jingyu Chen, W. Xiang, R. Evans, 2019, Dyes and Pigments.

An efficient non-fullerene acceptor based on central and peripheral naphthalene diimides.

S. Bhosale, W. Xiang, R. Evans, 2018, Chemical communications.

Significant Improvement of Optoelectronic and Photovoltaic Properties by Incorporating Thiophene in a Solution-Processable D–A–D Modular Chromophore

Hemlata Patil, S. Jackson, P. Sonar, 2015, Molecules.

EMBEDDED ATOM METHOD STUDY OF SURFACE ALLOYING OF Al ON Pd(001)

B. King, D. J. O'connor, A. Bilić, 1999 .

DISSOCIATED WATER ON Si(100): RELATION BETWEEN STM TOPOGRAPH AND ACTUAL GEOMETRY

N. Hush, J. Reimers, A. Bilić, 2004 .

Photo-spectroscopic properties of benzothiadiazole-containing pendant polymers for photovoltaic applications

G. J. Wilson, M. Häussler, S. Haque, 2011 .

Embedded atom method study of surface-confined Al on Ni(001)

B. King, D. J. O'connor, A. Bilić, 1999 .

Embedded Atom Method Study of Pd Thin Films on Cu(001)

B. King, D. J. O'connor, Yaogen Shen, 1998 .

Multiphonon He atom scattering in He → {Xe}/{Cu(111) } collisions

C. Wöll, J. Toennies, D. Fuhrmann, 1996 .

Proton mobility in the in-doped CaZrO3 perovskite oxide

J. Gale, A. Bilić, 2007 .

N-Alkyl functionalized barbituric and thiobarbituric acid bithiophene derivatives for vacuum deposited n-channel OFETs

C. Easton, C. Forsyth, T. Singh, 2014 .

Donor–Acceptor–Donor Modular Small Organic Molecules Based on the Naphthalene Diimide Acceptor Unit for Solution-Processable Photovoltaic Devices

Hemlata Patil, S. Jackson, K. Latham, 2014, Journal of Electronic Materials.

Molecular engineering for panchromatic absorbing oligothiophene donor–π–acceptor organic semiconductors

U. Bach, R. Evans, Akhil Gupta, 2012 .

A four-directional non-fullerene acceptor based on tetraphenylethylene and diketopyrrolopyrrole functionalities for efficient photovoltaic devices with a high open-circuit voltage of 1.18 V.

A. Rananaware, L. Jones, S. Bhargava, 2016, Chemical communications.

Single Layer Bismuth Iodide: Computational Exploration of Structural, Electrical, Mechanical and Optical Properties

A. Du, Zhongfang Chen, Guoping Gao, 2015, Scientific Reports.

Optical properties of a conjugated-polymer-sensitised solar cell: the effect of interfacial structure.

Y. Tachibana, S. Russo, A. Bilić, 2015, Physical chemistry chemical physics : PCCP.

New organic sensitizers using 4-(cyanomethyl)benzoic acid as an acceptor group for dye-sensitized solar cell applications

V. Armel, W. Xiang, R. Evans, 2015 .

Cyanomethylbenzoic acid: an acceptor for donor-π-acceptor chromophores used in dye-sensitized solar cells.

U. Bach, L. Spiccia, W. Xiang, 2013, ChemSusChem.

Insertion of a naphthalenediimide unit in a metal-free donor-acceptor organic sensitizer for efficiency enhancement of a dye-sensitized solar cell

A. Rananaware, S. Bhosale, W. Xiang, 2016 .

Novel organic sensitizer based on directly linked oligothiophenes to donor nitrogen atom for efficient dye-sensitized solar cells

V. Armel, W. Xiang, Akhil Gupta, 2014 .

Simulation of proton diffusion in In-doped CaZrO3

J. Gale, A. Bilić, 2008 .

Absorption enhancement of oligothiophene dyes through the use of a cyanopyridone acceptor group in solution-processed organic solar cells.

Udo Bach, G. J. Wilson, U. Bach, 2012, Chemical communications.

A Triphenylamine–Naphthalenediimide–Fullerene Triad: Synthesis, Photoinduced Charge Separation and Solution‐Processable Bulk Heterojunction Solar Cells

R. Bhosale, K. Ohkubo, L. Jones, 2018 .

Improvement of optoelectronic and photovoltaic properties through the insertion of a naphthalenediimide unit in donor–acceptor oligothiophenes

A. Rananaware, S. Bhosale, Akhil Gupta, 2015 .

Isoindigo-Based Small Molecules with Varied Donor Components for Solution-Processable Organic Field Effect Transistor Devices

Hemlata Patil, P. Sonar, Jishan Wu, 2015, Molecules.

Crowning of dibenzosilole with a naphthalenediimide functional group to prepare an electron acceptor for organic solar cells

Rahul V. Hangarge, A. Rananaware, L. Jones, 2015 .

A diketopyrrolopyrrole and benzothiadiazole based small molecule electron acceptor: design, synthesis, characterization and photovoltaic properties

Hemlata Patil, Hemlata Patil, Sheshanath V. Bhosale, 2014 .

A non-fullerene electron acceptor based on fluorene and diketopyrrolopyrrole building blocks for solution-processable organic solar cells with an impressive open-circuit voltage.

A. Rananaware, Hemlata Patil, S. Bhosale, 2014, Physical chemistry chemical physics : PCCP.

Adsorption of Benzene on Copper, Silver, and Gold Surfaces.

N. Hush, J. Reimers, M. Ford, 2006, Journal of chemical theory and computation.

Machine learning and genetic algorithm prediction of energy differences between electronic calculations of graphene nanoflakes

Michael Fernández, A. Bilić, A. S. Barnard, 2017, Nanotechnology.

Anomalous Enhancement of Mechanical Properties in the Ammonia Adsorbed Defective Graphene

A. Du, Zhongfang Chen, Ying Chen, 2016, Scientific Reports.

Substantial Band-Gap Tuning and a Strain-Controlled Semiconductor to Gapless/Band-Inverted Semimetal Transition in Rutile Lead/Stannic Dioxide.

A. Du, S. Sanvito, Guoping Gao, 2016, ACS applied materials & interfaces.

Two-Dimensional Boron Hydride Sheets: High Stability, Massless Dirac Fermions, and Excellent Mechanical Properties.

J. Bell, A. Du, A. Bilić, 2016, Angewandte Chemie.