Effect of dispersion on surface interactions of cobalt (II) octaethylporphyrin monolayer on Au (111) and HOPG (0001) substrates: a comparative first principles study B Chilukuri, U Mazur, KW Hipps Physical Chemistry Chemical Physics 16 (27), 14096-14107, 2014 | 78 | 2014 |
Use of [SbF6]− to Isolate Cationic Copper and Silver Adducts with More than One Ethylene on the Metal Center M Fianchini, CF Campana, B Chilukuri, TR Cundari, V Petricek, HVR Dias Organometallics 32 (10), 3034-3041, 2013 | 45 | 2013 |
Comprehensive structure–function correlation of photoactive ionic π-conjugated supermolecular assemblies: an experimental and computational study M Adinehnia, B Borders, M Ruf, B Chilukuri, KW Hipps, U Mazur Journal of Materials Chemistry C 4 (43), 10223-10239, 2016 | 38 | 2016 |
Molecular and electronic structure of cyclic trinuclear gold (I) carbeniate complexes: Insights for structure/luminescence/conductivity relationships RN McDougald Jr, B Chilukuri, H Jia, MR Perez, H Rabaâ, X Wang, ... Inorganic Chemistry 53 (14), 7485-7499, 2014 | 37 | 2014 |
Kinetically Trapped Two-Component Self-Assembled Adlayer A Jahanbekam, B Chilukuri, U Mazur, KW Hipps The Journal of Physical Chemistry C 119 (45), 25364-25376, 2015 | 35 | 2015 |
Surface directed reversible imidazole ligation to nickel (II) octaethylporphyrin at the solution/solid interface: a single molecule level study G Nandi, B Chilukuri, KW Hipps, U Mazur Physical Chemistry Chemical Physics 18 (30), 20819-20829, 2016 | 30 | 2016 |
Structure, properties, and reactivity of porphyrins on surfaces and nanostructures with periodic DFT calculations B Chilukuri, U Mazur, KW Hipps Applied Sciences 10 (3), 740, 2020 | 22 | 2020 |
Tuning the optoelectronic characteristics of ionic organic crystalline assemblies B Borders, M Adinehnia, B Chilukuri, M Ruf, KW Hipps, U Mazur Journal of Materials Chemistry C 6 (15), 4041-4056, 2018 | 18 | 2018 |
Polymorphic, porous, and host–guest nanostructures directed by monolayer–substrate interactions: epitaxial self-assembly study of cyclic trinuclear Au (I) complexes on Hopg at … B Chilukuri, RN McDougald Jr, MM Ghimire, VN Nesterov, U Mazur, ... The Journal of Physical Chemistry C 119 (44), 24844-24858, 2015 | 16 | 2015 |
Cooperativity and coverage dependent molecular desorption in self-assembled monolayers: computational case study with coronene on Au (111) and HOPG B Chilukuri, U Mazur, KW Hipps Physical Chemistry Chemical Physics 21 (20), 10505-10513, 2019 | 15 | 2019 |
Electronic and Charge-Transport Properties of the Au3(CH3NCOCH3)3 Crystal: A Density Functional Theory Study L Zhu, V Coropceanu, Y Yi, B Chilukuri, TR Cundari, JL Brédas The Journal of Physical Chemistry Letters 4 (13), 2186-2189, 2013 | 15 | 2013 |
Periodic and Molecular Modeling Study of Donor−Acceptor Interactions in (dbbpy)Pt(tdt)·TENF and [Pt(dbbpy)(tdt)]2·TENF TR Cundari, B Chilukuri, JM Hudson, C Minot, MA Omary, H Rabaâ Organometallics 29 (4), 795-800, 2010 | 15 | 2010 |
Au 3-to-Ag 3 coordinate-covalent bonding and other supramolecular interactions with covalent bonding strength Z Lu, B Chilukuri, C Yang, AMM Rawashdeh, RK Arvapally, SM Tekarli, ... Chemical Science 11 (41), 11179-11188, 2020 | 12 | 2020 |
Connecting Solution-Phase to Single-Molecule Properties of Ni (Salophen) YC Zhang, B Chilukuri, TB Hanson, ZM Heiden, DY Lee The Journal of Physical Chemistry Letters 10 (13), 3525-3530, 2019 | 12 | 2019 |
Cooperative Binding of 1-Phenylimidazole to Cobalt (II) Octaethylporphyrin on Graphite: A Quantitative Imaging and Computational Study at Molecular Resolution KV Korpany, B Chilukuri, KW Hipps, U Mazur The Journal of Physical Chemistry C 124 (34), 18639-18649, 2020 | 11 | 2020 |
Surface interactions of Au (I) cyclo-trimer with Au (111) and Al (111) surfaces: A computational study B Chilukuri, TR Cundari Surface science 606 (13-14), 1100-1107, 2012 | 9 | 2012 |
Structure and Bonding of Palladium Oxos as Possible Intermediates in Metal–Carbon Oxy Insertion Reactions TM Figg, G Schoendorff, B Chilukuri, TR Cundari Organometallics 32 (17), 4993-4996, 2013 | 8 | 2013 |
Modeling the Deposition of Metal Atoms on a p-Type Organometallic Conductor: Implications for Stability and Electron Transfer B Chilukuri, TR Cundari The Journal of Physical Chemistry C 115 (13), 5997-6003, 2011 | 8 | 2011 |
Role of the Supporting Surface in the Thermodynamics and Cooperativity of Axial Ligand Binding to Metalloporphyrins at Interfaces KN Johnson, B Chilukuri, ZE Fisher, KW Hipps, U Mazur Current Organic Chemistry 26 (6), 553-562, 2022 | 3 | 2022 |
In Situ Imaging and Computational Modeling Reveal That Thiophene Complexation with Co (II) porphyrin/Graphite Is Highly Cooperative KN Johnson, S Rana, B Chilukuri, KW Hipps, U Mazur The Journal of Physical Chemistry C 126 (45), 19188-19199, 2022 | 1 | 2022 |