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Ghosh, Abhik
Professor, Chemical Synthesis and Analysis
Job description
Professor, Chemical Synthesis and Analysis
- Terner, James; Kolle Ekaney, Thomas; Vazquez Lima, Hugo; Ghosh, Abhik. Structure-sensitive marker bands of metallocorroles: A resonance Raman study of manganese and gold corrole derivatives. Journal of Inorganic Biochemistry 2022; Volum 231. ISSN 0162-0134.s doi: 10.1016/j.jinorgbio.2022.111783.
- Alemayehu, Abraham; Mccormick-Mcpherson, Laura J; Conradie, Jeanet; Ghosh, Abhik. Rhenium Corrole Dimers: Electrochemical Insights into the Nature of the Metal–Metal Quadruple Bond. Inorganic Chemistry 2021; Volum 60. ISSN 0020-1669.s 8315 - 8321.s doi: 10.1021/acs.inorgchem.1c00986.
- Einrem, Rune Finsås; Jonsson, Einar Torfi; Teat, Simon J.; Settineri, Nicholas S.; Alemayehu, Abraham; Ghosh, Abhik. Regioselective formylation of rhenium-oxo and gold corroles: Substituent effects on optical spectra and redox potentials. (fulltekst) RSC Advances 2021; Volum 11 (54). ISSN 2046-2069.s 34086 - 34094.s doi: 10.1039/d1ra05525a.
- Ghosh, Abhik; Conradie, Jeanet. The Dog That Didn't Bark: A New Interpretation of Hypsoporphyrin Spectra and the Question of Hypsocorroles. (fulltekst) Journal of Physical Chemistry A 2021; Volum 125. ISSN 1089-5639.s 9962 - 9968.s doi: 10.1021/acs.jpca.1c08425.
- Conradie, Jeanet; Wamser, Carl C.; Ghosh, Abhik. Understanding Hyperporphyrin Spectra: TDDFT Calculations on Diprotonated Tetrakis(p-aminophenyl)porphyrin. (fulltekst) Journal of Physical Chemistry A 2021; Volum 125. ISSN 1089-5639.s 9953 - 9961.s doi: 10.1021/acs.jpca.1c06621.
- Matson, Benjamin D.; Kolle Ekaney, Thomas; Alemayehu, Abraham; Ghosh, Abhik; Sarangi, Ritimukta. X-ray absorption spectroscopy of exemplary platinum porphyrin and corrole derivatives: Metal-: versus ligand-centered oxidation. RSC Advances 2021; Volum 11 (51). ISSN 2046-2069.s 32269 - 32274.s doi: 10.1039/d1ra06151h.
- Vazquez-Lima, Hugo; Conradie, Jeanet; Johansen, Martin Amund Langaas; Martinsen, Stian; Alemayehu, Abraham; Ghosh, Abhik. Heavy-element-ligand covalence: Ligand noninnocence in molybdenum and tungsten Viking-helmet Corroles. (fulltekst) Dalton Transactions 2021; Volum 50 (37). ISSN 1477-9226.s 12843 - 12849.s doi: 10.1039/D1DT01970H.
- Curtis, Clayton J.; Astashkin, Andrei V.; Conradie, Jeanet; Ghosh, Abhik; Tomat, Elisa. Ligand-Centered Triplet Diradical Supported by a Binuclear Palladium(II) Dipyrrindione. (fulltekst) Inorganic Chemistry 2021; Volum 60. ISSN 0020-1669.s 12457 - 12466.s doi: 10.1021/acs.inorgchem.1c01691.
- Alemayehu, Abraham; Kolle Ekaney, Thomas; Einrem, Rune Finsås; Ghosh, Abhik. The Story of 5d Metallocorroles: From Metal–Ligand Misfits to New Building Blocks for Cancer Phototherapeutics. (fulltekst) Accounts of Chemical Research 2021; Volum 54. ISSN 0001-4842.s 3095 - 3107.s doi: 10.1021/acs.accounts.1c00290.
- Braband, Henrik; Benz, Michael; Spingler, Bernhard; Conradie, Jeanet; Roger, Alberto; Ghosh, Abhik. Relativity as a Synthesis Design Principle: A Comparative Study of [3 + 2] Cycloaddition of Technetium(VII) and Rhenium(VII) Trioxo Complexes with Olefins. (fulltekst) Inorganic Chemistry 2021; Volum 60. ISSN 0020-1669.s 11090 - 11097.s doi: 10.1021/acs.inorgchem.1c00995.
- Thomassen, Ivar Kristian; Rasmussen, Daniel; Einrem, Rune Finsås; Ghosh, Abhik. Simple, Axial Ligand-Mediated Route to Water-Soluble Iridium Corroles. (fulltekst) ACS Omega 2021; Volum 6. ISSN 2470-1343.s 16683 - 16687.s doi: 10.1021/acsomega.1c02399.
- Ghosh, Abhik. An Exemplary Gay Scientist and Mentor: Martin Gouterman (1931–2020). (fulltekst) Angewandte Chemie International Edition 2021; Volum 60 (18). ISSN 1433-7851.s 9760 - 9770.s doi: 10.1002/anie.202012840.
- Higashino, Tomohiro; Kurumisawa, Yuma; Alemayehu, Abraham; Einrem, Rune Finsås; Sahu, Debashis; Packwood, Daniel; Kato, Kosaku; Yamakata, Akira; Ghosh, Abhik; Imahori, Hiroshi. Heavy Metal Effects on the Photovoltaic Properties of Metallocorroles in Dye-Sensitized Solar Cells. ACS Applied Energy Materials 2020; Volum 3. ISSN 2574-0962.s 12460 - 12467.s doi: 10.1021/acsaem.0c02427.
- Kolle, Ekaney Thomas; Desbois, Nicolas; Conradie, Jeanet; Teat, Simon J.; Gros, Claude P; Ghosh, Abhik. Gold dipyrrin-bisphenolates: A combined experimental and DFT study of metal-ligand interactions. RSC Advances 2020; Volum 10 (1). ISSN 2046-2069.s 533 - 540.s doi: 10.1039/c9ra09228e.
- Krzystek, J.; Schnegg, Alexander; Aliabadi, Azar; Holldack, Karsten; Stoian, Sebastian A.; Ozarowski, Andrew; Hicks, Scott D.; Abu-Omar, Mahdi M.; Kolle Ekaney, Thomas; Ghosh, Abhik; Caulfield, Kenneth P.; Tonzetich, Zachary J.; Telser, Joshua. Advanced Paramagnetic Resonance Studies on Manganese and Iron Corroles with a Formal d4 Electron Count. Inorganic Chemistry 2020; Volum 59 (2). ISSN 0020-1669.s 1075 - 1090.s doi: 10.1021/acs.inorgchem.9b02635.
- Kolle Ekaney, Thomas; Conradie, Jeanet; Beavers, Christine M.; Ghosh, Abhik. Free-Base Porphyrins with Localized NH Protons. Can Substituents Alone Stabilize the Elusive Cis Tautomer?. Organic and biomolecular chemistry 2020; Volum 18. ISSN 1477-0520.s 2861 - 2865.s doi: 10.1039/d0ob00452a.
- Foroutan-Nejad, Cina; Vicha, Jan; Ghosh, Abhik. Relativity or aromaticity? A first-principles perspective of chemical shifts in osmabenzene and osmapentalene derivatives. Physical Chemistry, Chemical Physics - PCCP 2020; Volum 22 (19). ISSN 1463-9076.s 10863 - 10869.s doi: 10.1039/d0cp01481h.
- Cao, Rui; Kolle Ekaney, Thomas; Ghosh, Abhik; Sarangi, Ritimukta. X-ray absorption spectroscopy of archetypal chromium porphyrin and corrole derivatives. RSC Advances 2020; Volum 10 (35). ISSN 2046-2069.s 20572 - 20578.s doi: 10.1039/D0RA02335C.
- Hough, Michael A.; Conradie, Jeanet; Strange, Richard W.; Antonyuk, Svetlana V.; Eady, Robert R.; Ghosh, Abhik; Hasnain, Samar S.. Nature of the copper-nitrosyl intermediates of copper nitrite reductases during catalysis. Chemical Science 2020; Volum 11 (46). ISSN 2041-6520.s 12485 - 12492.s doi: 10.1039/D0SC04797J.
- Rahman, Md. Hafizur; Ryan, Michael D.; Vazquez-Lima, Hugo; Alemayehu, Abraham; Ghosh, Abhik. Infrared Spectroelectrochemistry of Iron-Nitrosyl Triarylcorroles. Implications for Ligand Noninnocence. Inorganic Chemistry 2020; Volum 59. ISSN 0020-1669.s 3232 - 3238.s doi: 10.1021/acs.inorgchem.9b03613.
- Reinholdt, Anders; Alemayehu, Abraham; Gagnon, Kevin J.; Bendix, Jesper; Ghosh, Abhik. Electrophilic Activation of Osmium-Nitrido Corroles: The OsN Triple Bond as a π-Acceptor Metallaligand in a Heterobimetallic OsVIN–PtII Complex. Inorganic Chemistry 2020; Volum 59. ISSN 0020-1669.s 5276 - 5280.s doi: 10.1021/acs.inorgchem.0c00654.
- Kolle Ekaney, Thomas; Slebodnick, Carla; Ghosh, Abhik. Facile Supramolecular Engineering of Porphyrin cis Tautomers: The Case of β-Octabromo-meso-tetraarylporphyrins. ACS Omega 2020; Volum 5. ISSN 2470-1343.s 8893 - 8901.s doi: 10.1021/acsomega.0c00517.
- Alemayehu, Abraham; Teat, Simon J.; Borisov, Sergey M.; Ghosh, Abhik. Rhenium-Imido Corroles. Inorganic Chemistry 2020; Volum 59. ISSN 0020-1669.s 6382 - 6389.s doi: 10.1021/acs.inorgchem.0c00477.
- Kolle Ekaney, Thomas; Settineri, Nicholas S.; Teat, Simon J.; Steene, Erik; Ghosh, Abhik. Molecular Structure of Copper and μ-Oxodiiron Octafluorocorrole Derivatives: Insights into Ligand Noninnocence. ACS Omega 2020; Volum 5. ISSN 2470-1343.s 10176 - 10182.s doi: 10.1021/acsomega.0c01035.
- Pierloot, Kristine; Phung, Quan Manh; Ghosh, Abhik. Electronic Structure of Neutral and Anionic Iron–Nitrosyl Corrole. A Multiconfigurational and Density Matrix Renormalization Group Investigation. Inorganic Chemistry 2020; Volum 59. ISSN 0020-1669.s 11493 - 11502.s doi: 10.1021/acs.inorgchem.0c01312.
- Alemayehu, Abraham; Einrem, Rune Finsås; Mccormick-Mcpherson, Laura J; Settineri, Nicholas S.; Ghosh, Abhik. Synthesis and molecular structure of perhalogenated rhenium-oxo corroles. Scientific Reports 2020; Volum 10. ISSN 2045-2322.s doi: 10.1038/s41598-020-76308-7.
- Thomassen, Ivar Kristian; Ghosh, Abhik. Protonation-Induced Hyperporphyrin Spectra of meso-Aminophenylcorroles. ACS Omega 2020; Volum 5. ISSN 2470-1343.s 9023 - 9030.s doi: 10.1021/acsomega.0c01068.
- Thomassen, Ivar Kristian; Mccormick-Mcpherson, Laura J; Borisov, Sergey M.; Ghosh, Abhik. Iridium Corroles Exhibit Weak Near-Infrared Phosphorescence but Efficiently Sensitize Singlet Oxygen Formation. Scientific Reports 2020; Volum 10. ISSN 2045-2322.s doi: 10.1038/s41598-020-64389-3.
- Einrem, Rune F.; Alemayehu, Abraham; Borisov, Sergey M.; Ghosh, Abhik; Gederaas, Odrun Arna. Amphiphilic rhenium-oxo corroles as a new class of sensitizers for photodynamic therapy. (fulltekst) ACS Omega 2020; Volum 5 (18). ISSN 2470-1343.s 10596 - 10601.s doi: 10.1021/acsomega.0c01090.
- Shan, Wenqian; Desbois, Nicolas; Pacquelet, Sandrine; Brandes, Stephane; Rousselin, Yoann; Conradie, Jeanet; Ghosh, Abhik; Gros, Claude P; Kadish, Karl M. Ligand Noninnocence in Cobalt Dipyrrin-Bisphenols: Spectroscopic, Electrochemical, and Theoretical Insights Indicating an Emerging Analogy with Corroles. Inorganic Chemistry 2019; Volum 58 (12). ISSN 0020-1669.s 7677 - 7689.s doi: 10.1021/acs.inorgchem.8b03006.
- Caulfield, Kenneth P; Conradie, Jeanet; Arman, Hadi D; Ghosh, Abhik; Tonzetich, Zachary. Iron(II) Corrole Anions. Inorganic Chemistry 2019; Volum 58 (22). ISSN 0020-1669.s 15225 - 15235.s doi: 10.1021/acs.inorgchem.9b02209.
- Alemayehu, Abraham; Vazquez-Lima, Hugo; Teat, Simon J.; Ghosh, Abhik. Unexpected Molecular Structure of a Putative Rhenium-Dioxo-Benzocarbaporphyrin Complex. Implications for the Highest Transition Metal Valence in a Porphyrin-Type Ligand Environment. ChemistryOpen 2019; Volum 8 (10). ISSN 2191-1363.s 1298 - 1302.s doi: 10.1002/open.201900271.
- Borisov, Sergey M.; Einrem, Rune Finsås; Alemayehu, Abraham; Ghosh, Abhik. Ambient-temperature near-IR phosphorescence and potential applications of rhenium-oxo corroles. Photochemical and Photobiological Sciences 2019; Volum 18 (5). ISSN 1474-905X.s 1166 - 1170.s doi: 10.1039/c8pp00473k.
- Larsen, Simon; Mccormick-Mcpherson, Laura J; Teat, Simon J.; Ghosh, Abhik. Azulicorrole. ACS Omega 2019; Volum 4 (4). ISSN 2470-1343.s 6737 - 6745.s doi: 10.1021/acsomega.9b00275.
- Conradie, Jeanet; Ghosh, Abhik. Theoretical Search for the Highest Valence States of the Coinage Metals: Roentgenium Heptafluoride May Exist. Inorganic Chemistry 2019; Volum 58 (13). ISSN 0020-1669.s 8735 - 8738.s doi: 10.1021/acs.inorgchem.9b01139.
- Ganguly, Sumit; Ghosh, Abhik. Seven Clues to Ligand Noninnocence: The Metallocorrole Paradigm. Accounts of Chemical Research 2019; Volum 52 (7). ISSN 0001-4842.s 2003 - 2014.s doi: 10.1021/acs.accounts.9b00115.
- Lim, Hyeongtaek; Kolle, Ekaney Thomas; Hedman, Britt; Hodgson, Keith O; Ghosh, Abhik; Solomon, Edward I.. X-ray Absorption Spectroscopy as a Probe of Ligand Noninnocence in Metallocorroles: The Case of Copper Corroles. Inorganic Chemistry 2019; Volum 58 (10). ISSN 0020-1669.s 6722 - 6730.s doi: 10.1021/acs.inorgchem.9b00128.
- Conradie, Jeanet; Foroutan-Nejad, Cina; Ghosh, Abhik. Norcorrole as a Delocalized, Antiaromatic System. Scientific Reports 2019; Volum 9. ISSN 2045-2322.s doi: 10.1038/s41598-019-39972-y.
- Ghosh, Abhik; Conradie, Jeanet. Stereochemistry of Transition-Metal Dinitrosyl Complexes. A Molecular Orbital Rationale for the Attracto and Repulso Conformations. Inorganic Chemistry 2019; Volum 58 (9). ISSN 0020-1669.s 5943 - 5948.s doi: 10.1021/acs.inorgchem.9b00266.
- Conradie, Jeanet; Brothers, Penelope Jane; Ghosh, Abhik. Main-Group-Element Isophlorin Complexes Revisited: The Question of a Subvalent Central Atom. Inorganic Chemistry 2019; Volum 58 (7). ISSN 0020-1669.s 4634 - 4640.s doi: 10.1021/acs.inorgchem.9b00201.
- Larsen, Simon; McCormick, Laura J; Ghosh, Abhik. Rapid one-pot synthesis of pyrrole-appended isocorroles. Organic and biomolecular chemistry 2019; Volum 17 (12). ISSN 1477-0520.s 3159 - 3166.s doi: 10.1039/c9ob00168a.
- Alemayehu, Abraham; McCormick, Laura J; Vazquez Lima, Hugo; Ghosh, Abhik. Relativistic Effects on a Metal-Metal Bond: Osmium Corrole Dimers. Inorganic Chemistry 2019; Volum 58 (4). ISSN 0020-1669.s 2798 - 2806.s doi: 10.1021/acs.inorgchem.8b03391.
- Foroutan-Nejad, Cina; Ghosh, Abhik. Magnetic Diversity in Heteroisocorroles: Aromatic Pathways in 10-Heteroatom-Substituted Isocorroles. ACS Omega 2018; Volum 3 (11). ISSN 2470-1343.s 15865 - 15869.s doi: 10.1021/acsomega.8b02626.
- Ghosh, Abhik; Larsen, Simon; Conradie, Jeanet; Foroutan-Nejad, Cina. Local versus global aromaticity in azuliporphyrin and benziporphyrin derivatives. Organic and biomolecular chemistry 2018; Volum 16 (42). ISSN 1477-0520.s 7964 - 7970.s doi: 10.1039/c8ob01672k.
- Tay, Aaron Chin Yit; Frogley, Benjamin J; Ware, David; Conradie, Jeanet; Ghosh, Abhik; Brothers, Penelope Jane. Tetrahedral Pegs in Square Holes: Stereochemistry of Diboron Porphyrazines and Phthalocyanines. Angewandte Chemie International Edition 2018; Volum 57. ISSN 1433-7851.s doi: 10.1002/anie.201810704.
- Alemayehu, Abraham; McCormick, Laura J; Gagnon, Kevin J.; Borisov, Sergey M.; Ghosh, Abhik. Stable Platinum(IV) Corroles: Synthesis, Molecular Structure, and Room-Temperature Near-IR Phosphorescence. ACS Omega 2018; Volum 3 (8). ISSN 2470-1343.s 9360 - 9368.s doi: 10.1021/acsomega.8b01149.
- Demissie, Taye Beyene; Conradie, Jeanet; Vazquez-Lima, Hugo; Ruud, Kenneth; Ghosh, Abhik. Rare and Nonexistent Nitrosyls: Periodic Trends and Relativistic Effects in Ruthenium and Osmium Porphyrin-Based {MNO}7 Complexes. (fulltekst) ACS Omega 2018; Volum 3 (9). ISSN 2470-1343.s 10513 - 10516.s doi: 10.1021/acsomega.8b01434.
- Kolle, Ekaney Thomas; Gagnon, Kevin J.; McCormick, Laura J; Ghosh, Abhik. Molecular structure of gold 2,3,7,8,12,13,17,18-octabromo-5,10,15-tris(4'-pentafluorosulfanylphenyl)corrole: Potential insights into the insolubility of gold octabromocorroles. Journal of Porphyrins and Phthalocyanines 2018; Volum 22 (7). ISSN 1088-4246.s 596 - 601.s doi: 10.1142/S1088424618500815.
- Foroutan-Nejad, Cina; Larsen, Simon; Conradie, Jeanet; Ghosh, Abhik. Isocorroles as Homoaromatic NIR-Absorbing Chromophores: A First Quantum Chemical Study. Scientific Reports 2018; Volum 8. ISSN 2045-2322.s doi: 10.1038/s41598-018-29819-3.
- Kolle, Ekaney Thomas; McCormick, Laura J; Carrie, Daniel; Vazquez Lima, Hugo; Simonneaux, Gerard; Ghosh, Abhik. Halterman Corroles and Their Use as a Probe of the Conformational Dynamics of the Inherently Chiral Copper Corrole Chromophore. Inorganic Chemistry 2018; Volum 57 (8). ISSN 0020-1669.s 4270 - 4276.s doi: 10.1021/acs.inorgchem.7b02767.
- Ganguly, Sumit; McCormick, Laura J; Conradie, Jeanet; Gagnon, Kevin J.; Sarangi, Ritimukta; Ghosh, Abhik. Electronic Structure of Manganese Corroles Revisited: X-ray Structures, Optical and X-ray Absorption Spectroscopies, and Electrochemistry as Probes of Ligand Noninnocence. Inorganic Chemistry 2018; Volum 57 (16). ISSN 0020-1669.s 9656 - 9669.s doi: 10.1021/acs.inorgchem.8b00537.
- Thomassen, Ivar Kristian; McCormick, Laura J; Ghosh, Abhik. Molecular Structure of a Free-Base β-Octaiodo-meso-tetraarylporphyrin. A Rational Route to cis Porphyrin Tautomers?. Crystal Growth & Design 2018; Volum 18 (8). ISSN 1528-7483.s 4257 - 4259.s doi: 10.1021/acs.cgd.8b00629.
- Thomassen, Ivar Kristian; McCormick, Laura J.; Ghosh, Abhik. Synthesis and Molecular Structure of a Copper Octaiodocorrole. ACS Omega 2018; Volum 3 (5). ISSN 2470-1343.s 5106 - 5110.s doi: 10.1021/acsomega.8b00616.
- Song, Yang; Fang, Yuanyuan; Ou, Zhongping; Capar, Jan; Wang, Chenyi; Conradie, Jeanet; Kolle, Ekaney Thomas; Wamser, Carl C; Ghosh, Abhik; Kadish, Karl M. Influence of β-octabromination on free-base triarylcorroles: Electrochemistry and protonation-deprotonation reactions in nonaqueous media. Journal of Porphyrins and Phthalocyanines 2017; Volum 21 (10). ISSN 1088-4246.s 633 - 645.s doi: 10.1142/S1088424617500602.
- Ghosh, Abhik. Electronic structure of corrole derivatives: Insights from molecular structures, spectroscopy, electrochemistry, and quantum chemical calculations. Chemical Reviews 2017; Volum 117 (4). ISSN 0009-2665.s 3798 - 3881.s doi: 10.1021/acs.chemrev.6b00590.
- Norheim, Hans-Kristian; Schneider, Christian; Gagnon, Kevin J.; Ghosh, Abhik. One-Pot Synthesis of a bis-Pocket Corrole through a 14-fold Bromination Reaction. ChemistryOpen 2017; Volum 6 (2). ISSN 2191-1363.s 221 - 225.s doi: 10.1002/open.201600168.
- Kolle, Ekaney Thomas; Beavers, Christine M.; Gagnon, Kevin J.; Ghosh, Abhik. β-Octabromo- and β-Octakis(trifluoromethyl)isocorroles: New Sterically Constrained Macrocyclic Ligands. ChemistryOpen 2017; Volum 6 (3). ISSN 2191-1363.s 402 - 409.s doi: 10.1002/open.201700035.
- Schies, Christine; Alemayehu, Abraham; Vazquez Lima, Hugo; Kolle, Ekaney Thomas; Bruhn, Torsten; Bringmann, Gerhard; Ghosh, Abhik. Metallocorroles as inherently chiral chromophores: Resolution and electronic circular dichroism spectroscopy of a tungsten biscorrole. (fulltekst) Chemical Communications 2017; Volum 53 (45). ISSN 1359-7345.s 6121 - 6124.s doi: 10.1039/c7cc02027a.
- Uddin, Main; Biswas, Dipankar; Ghosh, Abhik; O'Kennedy, Niamh; Duttaroy, Asim K.. Consumption of Fruitflow® lowers blood pressure in pre-hypertensive males: a randomised, placebo controlled, double blind, cross-over study. International Journal of Food Sciences and Nutrition 2017; Volum 69 (4). ISSN 0963-7486.s 494 - 502.s doi: 10.1080/09637486.2017.1376621.
- Ganguly, Sumit; Conradie, Jeanet; Bendix, Jesper; Gagnon, Kevin J.; McCormick, Laura J.; Ghosh, Abhik. Electronic Structure of Cobalt–Corrole–Pyridine Complexes: Noninnocent Five-Coordinate Co(II) Corrole–Radical States. Journal of Physical Chemistry A 2017; Volum 121 (50). ISSN 1089-5639.s 9589 - 9598.s doi: 10.1021/acs.jpca.7b09440.
- Ganguly, Sumit; Diemo, Renz; Giles, Logan J.; Gagnon, Kevin J.; McCormick, Laura J; Conradie, Jeanet; Sarangi, Ritimukta; Ghosh, Abhik. Cobalt- and Rhodium-Corrole-Triphenylphosphine Complexes Revisited: The Question of a Noninnocent Corrole. Inorganic Chemistry 2017; Volum 56 (24). ISSN 0020-1669.s 14788 - 14800.s doi: 10.1021/acs.inorgchem.7b01828.
- Conradie, Jeanet; Ghosh, Abhik. Energetics of saddling versus ruffling in metalloporphyrins: Unusual ruffled dodecasubstituted porphyrins. ACS Omega 2017; Volum 2 (10). ISSN 2470-1343.s 6708 - 6714.s doi: 10.1021/acsomega.7b01004.
- Ganguly, Sumit; Giles, Logan J.; Kolle, Ekaney Thomas; Sarangi, Ritimukta; Ghosh, Abhik. Ligand Noninnocence in Iron Corroles: Insights from Optical and X-ray Absorption Spectroscopies and Electrochemical Redox Potentials. Chemistry - A European Journal 2017; Volum 23 (60). ISSN 0947-6539.s 15098 - 15106.s doi: 10.1002/chem.201702621.
- Kolle, Ekaney Thomas; McCormick, Laura J; Vazquez Lima, Hugo; Ghosh, Abhik. Stabilization and Structure of the cis Tautomer of a Free-Base Porphyrin. Angewandte Chemie International Edition 2017; Volum 56 (34). ISSN 1433-7851.s 10088 - 10092.s doi: 10.1002/anie.201701965.
- Alemayehu, Abraham; Vazquez Lima, Hugo; McCormick, Laura J; Ghosh, Abhik. Relativistic effects in metallocorroles: Comparison of molybdenum and tungsten biscorroles. Chemical Communications 2017; Volum 53 (43). ISSN 1359-7345.s 5830 - 5833.s doi: 10.1039/c7cc01549f.
- Alemayehu, Abraham; Vazquez Lima, Hugo; Gagnon, Kevin J.; Ghosh, Abhik. Stepwise Deoxygenation of Nitrite as a Route to Two Families of Ruthenium Corroles: Group 8 Periodic Trends and Relativistic Effects. Inorganic Chemistry 2017; Volum 56 (9). ISSN 0020-1669.s 5285 - 5294.s doi: 10.1021/acs.inorgchem.7b00377.
- Einrem, Rune; Braband, Henrik; Fox, Thomas; Vazquez Lima, Hugo; Alberto, Roger A.; Ghosh, Abhik. Synthesis and molecular structure of 99Tc corroles. Chemistry - A European Journal 2016; Volum 22 (52). ISSN 0947-6539.s 18747 - 18751.s doi: 10.1002/chem.201605015.
- Capar, Jan; Zonneveld, Job; Berg, Steffen; Isaksson, Johan; Gagnon, Kevin J.; Kolle, Ekaney Thomas; Ghosh, Abhik. Demetalation of copper undecaarylcorroles: Molecular structures of a free-base undecaarylisocorrole and a gold undecaarylcorrole. Journal of Inorganic Biochemistry 2016; Volum 162. ISSN 0162-0134.s 146 - 153.s doi: 10.1016/j.jinorgbio.2016.06.026.
- Alemayehu, Abraham; Day, Nicholas U.; Mani, Tomoyasu; Rudine, Alexander B.; Kolle, Ekaney Thomas; Gederaas, Odrun Arna; Vinogradov, Sergei A.; Wamser, Carl C.; Ghosh, Abhik. Gold Tris(carboxyphenyl)corroles as Multifunctional Materials: Room Temperature Near-IR Phosphorescence and Applications to Photodynamic Therapy and Dye-Sensitized Solar Cells. ACS Applied Materials & Interfaces 2016; Volum 8 (29). ISSN 1944-8244.s 18935 - 18942.s doi: 10.1021/acsami.6b04269.
- Borisov, Sergey M.; Alemayehu, Abraham; Ghosh, Abhik. Osmium-nitrido corroles as NIR indicators for oxygen sensors and triplet sensitizers for organic upconversion and singlet oxygen generation. Journal of Materials Chemistry C 2016; Volum 4 (24). ISSN 2050-7526.s 5822 - 5828.s doi: 10.1039/c6tc01126h.
- Einrem, Rune; Gagnon, Kevin J.; Alemayehu, Abraham; Ghosh, Abhik. Metal-Ligand Misfits: Facile Access to Rhenium-Oxo Corroles by Oxidative Metalation. Chemistry - A European Journal 2016; Volum 22 (2). ISSN 0947-6539.s 517 - 520.s doi: 10.1002/chem.201504307.
- Conradie, Jeanet; Ghosh, Abhik. Metalloporphyrin-Nitroxyl Interactions: The Low-Energy States of Reduced Manganese, Iron, and Cobalt Porphyrin Nitrosyls. Journal of Physical Chemistry B 2016; Volum 120 (22). ISSN 1520-6106.s 4972 - 4979.s doi: 10.1021/acs.jpcb.6b04983.
- Ganguly, Sumit; Vazquez Lima, Hugo; Ghosh, Abhik. Wolves in sheep's clothing: μ-oxo-diiron corroles revisited. Chemistry - A European Journal 2016; Volum 22 (30). ISSN 0947-6539.s 10336 - 10340.s doi: 10.1002/chem.201601062.
- Ghosh, Abhik; Conradie, Jeanet. The Valence States of Copernicium and Flerovium. European Journal of Inorganic Chemistry (EurJIC) 2016; Volum 2016 (18). ISSN 1434-1948.s 2989 - 2992.s doi: 10.1002/ejic.201600146.
- Sarangi, Ritimukta; Giles, Logan J.; Kolle, Ekaney Thomas; Ghosh, Abhik. Ligand Noninnocence in Silver Corroles: A XANES Investigation. European Journal of Inorganic Chemistry (EurJIC) 2016; Volum 2016 (20). ISSN 1434-1948.s 3225 - 3227.s doi: 10.1002/ejic.201600413.
- Vazquez Lima, Hugo; Conradie, Jeanet; Ghosh, Abhik. Metallocorrole Interactions with Carbon Monoxide, Nitric Oxide, and Nitroxyl - A DFT Study of Low-Energy Bound States. Inorganic Chemistry 2016; Volum 55 (17). ISSN 0020-1669.s 8248 - 8250.s doi: 10.1021/acs.inorgchem.6b01189.
- Alemayehu, Abraham; Vazquez Lima, Hugo; Gagnon, Kevin J.; Ghosh, Abhik. Tungsten Biscorroles: New Chiral Sandwich Compounds. Chemistry - A European Journal 2016; Volum 22 (20). ISSN 0947-6539.s 6914 - 6920.s doi: 10.1002/chem.201504848.
- Walter, Melody R.; Dzul, Stephen P.; Rodrigues, Andria V.; Stemmler, Timothy L.; Telser, Joshua; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C.. Synthesis of CoII-NO- complexes and their reeactivity as a source of nitroxyl. Journal of the American Chemical Society 2016; Volum 138 (38). ISSN 0002-7863.s 12459 - 12471.s doi: 10.1021/jacs.6b05896.
- Ghosh, Abhik; Conradie, Jeanet. Pentafluorosulfanyltrimethylsilane: A nonexistent molecule?. European Journal of Inorganic Chemistry (EurJIC) 2015; Volum 2015 (2). ISSN 1434-1948.s 207 - 209.s doi: 10.1002/ejic.201402928.
- Capar, Jan; Conradie, Jeanet; Beavers, Christine M.; Ghosh, Abhik. Molecular Structures of Free-Base Corroles: Nonplanarity, Chirality, and Enantiomerization. Journal of Physical Chemistry A 2015; Volum 119 (14). ISSN 1089-5639.s 3452 - 3457.s doi: 10.1021/jp511188c.
- Hopmann, Kathrin Helen; Conradie, Jeanet; Tangen, Espen; Tonzetich, Zachary; Lippard, Stephen; Ghosh, Abhik. Singlet–triplet gaps of cobalt nitrosyls: insights from tropocoronand complexes. Inorganic Chemistry 2015; Volum 54 (15). ISSN 0020-1669.s 7362 - 7367.s doi: 10.1021/acs.inorgchem.5b00901.
- Conradie, Jeanet; Patra, Ashis K.; Harrop, Todd C.; Ghosh, Abhik. Square-antiprismatic eight-coordinate complexes of divalent first-row transition metal cations: A density functional theory exploration of the electronic-structural landscape. Inorganic Chemistry 2015; Volum 54 (4). ISSN 0020-1669.s 1375 - 1383.s doi: 10.1021/ic502287m.
- Conradie, Jeanet; Berg, Steffen; Ghosh, Abhik. Mechanisms of oxygen atom transfer between main-group elements. European Journal of Inorganic Chemistry (EurJIC) 2015; Volum 2015 (24). ISSN 1434-1948.s 4138 - 4144.s doi: 10.1002/ejic.201500591.
- Vazquez-Lima, Hugo; Norheim, Hans-Kristian; Einrem, Rune; Ghosh, Abhik. Cryptic noninnocence: FeNO corroles in a new light. Dalton Transactions 2015; Volum 44 (22). ISSN 1477-9226.s 10146 - 10151.s doi: 10.1039/c5dt01495f.
- Kolle, Ekaney Thomas; Vazquez-Lima, Hugo; Fang, YuanYuan; Song, Yang; Gagnon, Kevin J.; Beavers, Christine; Kadish, Karl M; Ghosh, Abhik. Ligand Noninnocence in Coinage Metal Corroles: A Silver Knife-Edge. Chemistry - A European Journal 2015; Volum 21 (47). ISSN 0947-6539.s 16839 - 16847.s doi: 10.1002/chem.201502150.
- Thomassen, Ivar Kristian; Vazquez-Lima, Hugo; Gagnon, Kevin J.; Ghosh, Abhik. Octaiodoporphyrin. Inorganic Chemistry 2015; Volum 54 (23). ISSN 0020-1669.s 11493 - 11497.s doi: 10.1021/acs.inorgchem.5b02127.
- Norheim, Hans-Kristian; Capar, Jan; Einrem, Rune; Gagnon, Kevin J.; Beavers, Christine; Vazquez-Lima, Hugo; Ghosh, Abhik. Ligand noninnocence in FeNO corroles: insights from β-octabromocorrole complexes. Dalton Transactions 2015; Volum 45 (2). ISSN 1477-9226.s 681 - 689.s doi: 10.1039/c5dt03947a.
- Capar, Jan; Berg, Steffen; Kolle, Ekaney Thomas; Beavers, Christine M.; Gagnon, Kevin J.; Ghosh, Abhik. Improved syntheses of β-octabromo-meso-triarylcorrole derivatives. Journal of Inorganic Biochemistry 2015; Volum 153. ISSN 0162-0134.s 162 - 166.s doi: 10.1016/j.jinorgbio.2015.07.017.
- Berg, Steffen; Ghosh, Abhik. DFT calculations in descriptive inorganic chemistry: From active learning to citizen science. Abstract of Papers of the American Chemical Society 2014; Volum 248. ISSN 0065-7727.
- Berg, Steffen; Ghosh, Abhik. Curing xenonphobia: Making sense of xenon-'s complex chemistry with arrow-pushing. Abstract of Papers of the American Chemical Society 2014; Volum 248. ISSN 0065-7727.
- Alemayehu, Abraham; Lima, Hugo Vazquez; Beavers, Christine M.; Gagnon, Kevin J.; Bendix, Jesper; Ghosh, Abhik. Platinum corroles. Chemical Communications 2014. ISSN 1359-7345.s doi: 10.1039/c4cc02548b.
- Yun, Lin; Lima, Hugo Vazquez; Fang, Huayi; Yao, Zhengmin; Geisberger, Georg; Dietl, Chtistian; Ghosh, Abhik; Brothers, Penelope J.; Fu, Xuefeng. Synthesis and reactivity studies of a tin(II) corrole complex. Inorganic Chemistry 2014; Volum 53 (13). ISSN 0020-1669.s 7047 - 7054.s doi: 10.1021/ic501103c.
- Conradie, Jeanet; Ghosh, Abhik. Stereochemical Diversity of {MNO}10 Complexes: Molecular Orbital Analyses of Nickel and Copper Nitrosyls. Inorganic Chemistry 2014; Volum 53 (10). ISSN 0020-1669.s 4847 - 4855.s doi: 10.1021/ic4028157.
- Albrett, Amelia M.; Kolle, Ekaney Thomas; Maslek, Stefanie; Mlodzianowska, Anna; Conradie, Jeanet; Beavers, Christine M.; Ghosh, Abhik; Brothers, Penelope J.. Mono- and diboron corroles: Factors controlling stoichiometry and hydrolytic reactivity. Inorganic Chemistry 2014; Volum 53 (11). ISSN 0020-1669.s 5486 - 5493.s doi: 10.1021/ic500114k.
- Berg, Steffen; Ghosh, Abhik. Six Impossible Mechanisms Before Breakfast: Arrow Pushing as an Instructional Device in Inorganic Chemistry. Journal of Chemical Education 2013; Volum 90 (11). ISSN 0021-9584.s 1446 - 1451.s doi: 10.1021/ed3006693.
- Patra, Ashis K.; Dube, Koustubh S.; Sanders, Brian C.; Papaefthymiou, Georgia C.; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C.. A thermally stable {FeNO}(8) complex: properties and biological reactivity of reduced MNO systems. Chemical Science 2012; Volum 3 (2). ISSN 2041-6520.s 364 - 369.s doi: 10.1039/c1sc00582k.
- Kolle, Ekaney Thomas; Beavers, Christine M.; Ghosh, Abhik. Molecular structure of a gold beta-octakis(trifluoromethyl)-meso-triarylcorrole: an 85 degrees difference in saddling dihedral relative to copper. Molecular Physics 2012; Volum 110 (19-20). ISSN 0026-8976.s 2439 - 2444.s doi: 10.1080/00268976.2012.695031.
- Berg, Steffen; Kolle, Ekaney Thomas; Beavers, Christine M.; Ghosh, Abhik. Undecaphenylcorroles. Inorganic Chemistry 2012; Volum 51 (18). ISSN 0020-1669.s 9911 - 9916.s doi: 10.1021/ic301388e.
- Zhao, Hailang; Pierloot, Kristine; Langner, Ernie HG; Swarts, Jannie C; Conradie, Jeanet; Ghosh, Abhik. Low-Energy States of Manganese-Oxo Corrole and Corrolazine: Multiconfiguration Reference ab Initio Calculations. Inorganic Chemistry 2012; Volum 51 (7). ISSN 0020-1669.s 4002 - 4006.s doi: 10.1021/ic201972f.
- Alemayehu, Abraham; Conradie, Marianne Marrigje; Ghosh, Abhik. Electronic absorption spectra of copper corroles: unexpected substituent effects in trans-meso-A(2)B-triarylcorrole complexes. Journal of Porphyrins and Phthalocyanines 2012; Volum 16 (5-6). ISSN 1088-4246.s 695 - 704.s doi: 10.1142/S108842461250085X.
- Kolle, Ekaney Thomas; Alemayehu, Abraham; Conradie, Jeanet; Beavers, Christine M.; Ghosh, Abhik. The Structural Chemistry of Metallocorroles: Combined X-ray Crystallography and Quantum Chemistry Studies Afford Unique Insights. Accounts of Chemical Research 2012; Volum 45 (8). ISSN 0001-4842.s 1203 - 1214.s doi: 10.1021/ar200292d.
- Conradie, Marianne Marrigje; Conradie, Jeanet; Ghosh, Abhik. Capturing the spin state diversity of iron(III)-aryl porphyrins OLYP is better than TPSSh. Journal of Inorganic Biochemistry 2011; Volum 105 (1). ISSN 0162-0134.s 84 - 91.s doi: 10.1016/j.jinorgbio.2010.09.010.
- Johansen, Inge; Norheim, Hans-Kristian; Larsen, Simon; Alemayehu, Abraham; Conradie, Jeanet; Ghosh, Abhik. Substituent effects on metallocorrole spectra: insights from chromium-oxo and molybdenum-oxo triarylcorroles. Journal of Porphyrins and Phthalocyanines 2011; Volum 15 (11-12). ISSN 1088-4246.s 1335 - 1344.s doi: 10.1142/S1088424611004270.
- Kolle, Ekaney Thomas; Alemayehu, Abraham; Conradie, Jeanet; Beavers, Christine; Ghosh, Abhik. Synthesis and Molecular Structure of Gold Triarylcorroles. Inorganic Chemistry 2011; Volum 50 (24). ISSN 0020-1669.s 12844 - 12851.s doi: 10.1021/ic202023r.
- Sandala, Gregory M.; Hopmann, Kathrin Helen; Ghosh, Abhik; Noodleman, Louis. Calibration of DFT Functionals for the Prediction of Fe-57 Mossbauer Spectral Parameters in Iron-Nitrosyl and Iron-Sulfur Complexes: Accurate Geometries Prove Essential. Journal of Chemical Theory and Computation 2011; Volum 7 (10). ISSN 1549-9618.s 3232 - 3247.s doi: 10.1021/ct200187d.
- Berg, Steffen; Ghosh, Abhik. Arrow Pushing: A Rational, Participatory Approach To Teaching Descriptive Inorganic Chemistry. Journal of Chemical Education 2011; Volum 88 (12). ISSN 0021-9584.s 1663 - 1666.s doi: 10.1021/ed200166z.
- Chamberlin, Adam; Ikezaki, Akira; Nakamura, Mikio; Ghosh, Abhik. Iron Porphyrin Dications with Neutral Axial Ligands: DFT Calculations Delineate Similarities with Heme Protein Compound II Intermediates. Journal of Physical Chemistry B 2011; Volum 115 (13). ISSN 1520-6106.s 3642 - 3647.s doi: 10.1021/jp111109e.
- Hopmann, Kathrin Helen; Cardey, Bruno; Gladwin, Mark T.; Kim-Shapiro, Daniel B.; Ghosh, Abhik. Hemoglobin as a Nitrite Anhydrase: Modeling Methemoglobin-Mediated N2O3 Formation. Chemistry - A European Journal 2011; Volum 17 (23). ISSN 0947-6539.s 6348 - 6358.s doi: 10.1002/chem.201003578.
- Alemayehu, Abraham; Ghosh, Abhik. Gold corroles. Journal of Porphyrins and Phthalocyanines 2011; Volum 15 (2). ISSN 1088-4246.s 106 - 110.s doi: 10.1142/S1088424611003045.
- Kolle, Ekaney Thomas; Conradie, Jeanet; Hansen, Lars Kr; Ghosh, Abhik. Corroles Cannot Ruffle. Inorganic Chemistry 2011; Volum 50 (8). ISSN 0020-1669.s 3247 - 3251.s doi: 10.1021/ic1017032.
- Conradie, Jeanet; Ghosh, Abhik. Correlation between the FeNO Angle and d-p Mixing in {FeNO}(7) Complexes. Inorganic Chemistry 2011; Volum 50 (10). ISSN 0020-1669.s 4223 - 4225.s doi: 10.1021/ic102388c.
- Hopmann, Kathrin Helen; Ghosh, Abhik. Mechanism of Cobalt-Porphyrin-Catalyzed Aziridination. Journal of the American Chemical Society 2011; Volum 1 (6). ISSN 0002-7863.s 597 - 600.s doi: 10.1021/cs1001114.
- Ghosh, Abhik. Ab initio wavefunctions in bioinorganic chemistry: More than a succes d'estime?. JBIC Journal of Biological Inorganic Chemistry 2011; Volum 16 (6). ISSN 0949-8257.s 819 - 820.s doi: 10.1007/s00775-011-0816-5.
- Ikeue, Takahisa; Handa, Makoto; Chamberlin, Adam; Ghosh, Abhik; Ongayi, Owendi; Vicente, M. Graca H.; Ikezaki, Akira; Nakamura, Mikio. Benzoannelation Stabilizes the d(xy)(1) State of Low-Spin Iron(III) Porphyrinates. Inorganic Chemistry 2011; Volum 50 (8). ISSN 0020-1669.s 3567 - 3581.s doi: 10.1021/ic1024873.
- Kolle, Ekaney Thomas; Conradie, Jeanet; Hansen, Lars Kr; Ghosh, Abhik. A Metallocorrole with Orthogonal Pyrrole Rings. European Journal of Inorganic Chemistry (EurJIC) 2011 (12). ISSN 1434-1948.s 1865 - 1870.s doi: 10.1002/ejic.201100170.
- Alemayehu, Abraham; Conradie, Jeanet; Ghosh, Abhik. A First TDDFT Study of Metallocorrole Electronic Spectra: Copper meso-Triarylcorroles Exhibit Hyper Spectra. European Journal of Inorganic Chemistry (EurJIC) 2011 (12). ISSN 1434-1948.s 1857 - 1864.s doi: 10.1002/ejic.201001026.
- Gonzalez, Emmanuel; Brothers, Penelope J.; Ghosh, Abhik. Density Functional Theory Calculations on Ruthenium(IV) Bis(amido) Porphyrins: Search for a Broader Perspective of Heme Protein Compound II Intermediates. Journal of Physical Chemistry B 2010; Volum 114 (46). ISSN 1520-6106.s 15380 - 15388.s doi: 10.1021/jp107692m.
- Patra, AK; Dube, KS; Papaefthymiou, GC; Conradie, Jeanet; Ghosh, Abhik; Harrop, TC. Stable Eight-Coordinate Iron(III/II) Complexes. Inorganic Chemistry 2010; Volum 49 (5). ISSN 0020-1669.s 2032 - 2034.s doi: 10.1021/ic1001336.
- Tangen, Espen; Conradie, Jeanet; Franz, K; Friedle, S; Telser, J; Lippard, SJ; Ghosh, Abhik. Electronic Structure of a Paramagnetic {MNO}(6) Complex: MnNO 5,5-Tropocoronand. Inorganic Chemistry 2010; Volum 49 (6). ISSN 0020-1669.s 2701 - 2705.s doi: 10.1021/ic901860x.
- Conradie, Jeanet; Ghosh, Abhik. Electronic Structure of an Iron-Porphyrin-Nitrene Complex. Inorganic Chemistry 2010; Volum 49 (1). ISSN 0020-1669.s 243 - 248.s doi: 10.1021/ic901897w.
- Gonzalez, Emmanuel; Ghosh, Abhik. Reductive coupling and protonation leading to diboron corroles with a B-H-B bridge. Dalton Transactions 2010; Volum 39 (17). ISSN 1477-9226.s 4032 - 4034.s doi: 10.1039/c002885c.
- Alemayehu, Abraham; Hansen, Lars Kr; Ghosh, Abhik. Nonplanar, Noninnocent, and Chiral: A Strongly Saddled Metallocorrole. Inorganic Chemistry 2010; Volum 49 (17). ISSN 0020-1669.s 7608 - 7610.s doi: 10.1021/ic1008736.
- Capar, Can; Hansen, Lars Kr; Conradie, Jeanet; Ghosh, Abhik. beta-octabromo-meso-tris(pentafluorophenyl)corrole: reductive demetalation-based synthesis of a heretofore inaccessible, perhalogenated free-base corrole. Journal of Porphyrins and Phthalocyanines 2010; Volum 14 (6). ISSN 1088-4246.s 509 - 512.s doi: 10.1142/S1088424610002331.
- Conradie, Jeanet; Hopmann, Kathrin Helen; Ghosh, Abhik. Understanding the Unusually Straight: A Search For MO Insights into Linear {FeNO}(7) Units. Journal of Physical Chemistry B 2010; Volum 114 (25). ISSN 1520-6106.s 8517 - 8524.s doi: 10.1021/jp101847y.
- Hopmann, Kathrin Helen; Noodleman, L; Ghosh, Abhik. Spin Coupling in Roussin's Red and Black Salts. Chemistry - A European Journal 2010; Volum 16 (34). ISSN 0947-6539.s 10397 - 10408.s doi: 10.1002/chem.200903344.
- Hopmann, Kathrin Helen; Ghosh, Abhik; Noodleman, L. Density Functional Theory Calculations on Mossbauer Parameters of Nonheme Iron Nitrosyls. Inorganic Chemistry 2009; Volum 48 (19). ISSN 0020-1669.s 9155 - 9165.s doi: 10.1021/ic9008784.
- Alemayehu, Abraham; Gonzalez, Emmanuel; Hansen, Lars Kr; Ghosh, Abhik. Copper Corroles Are Inherently Saddled. Inorganic Chemistry 2009; Volum 48 (16). ISSN 0020-1669.s 7794 - 7799.s doi: 10.1021/ic900744v.
- Hopmann, Kathrin Helen; Conradie, Jeanet; Ghosh, Abhik. Broken-Symmetry DFT Spin Densities of Iron Nitrosyls, Including Roussin's Red and Black Salts: Striking Differences between Pure and Hybrid Functionals. Journal of Physical Chemistry B 2009; Volum 113 (30). ISSN 1520-6106.s 10540 - 10547.s doi: 10.1021/jp904135h.
- Conradie, J; Ghosh, Abhik. Bonding in Low-Coordinate Environments: Electronic Structure of Distorted Square-Planar Iron-imido Complexes With Pincer-Type Ligands. Journal of Chemical Theory and Computation 2008; Volum 4 (10). ISSN 1549-9618.s 1576 - 1584.s doi: 10.1021/ct800118c.
- Ghosh, Abhik; Gonzalez, Emmanuel; Tangen, Espen; Roos, Bjørn. Mapping the d−d Excited-State Manifolds of Transition Metal β-Diiminato−Imido Complexes. Comparison of Density Functional Theory and CASPT2 Energetics. Journal of Physical Chemistry A 2008. ISSN 1089-5639.s 12792 - 12798.s doi: 10.1021/jp711159h.
- Albrett, AM; Conradie, J; Ghosh, Abhik; Brothers, PJ. DFT survey of monoboron and diboron corroles: regio- and stereochemical preferences for a constrained, low- symmetry macrocycle. Dalton Transactions 2008. ISSN 1477-9226.s 4464 - 4473.s doi: 10.1039/b718755f.
- Aquilante, F; Malmqvist, PA; Pedersen, TB; Ghosh, Abhik; Roos, BO. Cholesky decomposition-based multiconfiguration second-order perturbation theory (CD-CASPT2): Application to the spin-state energetics of Co-III(diiminato)(NPh). Journal of Chemical Theory and Computation 2008; Volum 4 (5). ISSN 1549-9618.s 694 - 702.s doi: 10.1021/ct700263h.
- Albrett, AM; Conradie, J; Boyd, PDW; Clark, GR; Ghosh, Abhik; Brothers, PJ. Corrole as a binucleating ligand: Preparation, molecular structure and density functional theory study of diboron corroles. Journal of the American Chemical Society 2008; Volum 130 (10). ISSN 0002-7863.s 2888 - 2889.s doi: 10.1021/ja077785u.
- Conradie, Jeanet; Wondimagegn, Tebikie; Ghosh, Abhik. Spin states at a tipping point: What determines the d(z)(2l) ground state of nickel(III) Tetra((t)butyl)porphyrin dicyanide?. Journal of Physical Chemistry B 2008; Volum 112 (4). ISSN 1520-6106.s 1053 - 1056.s doi: 10.1021/jp709980y.
- Capar, Can; Kolle, Ekaney Thomas; Ghosh, Abhik. Reductive demetalation of copper corroles: first simple route to free-base beta-octabromocorroles. Journal of Porphyrins and Phthalocyanines 2008; Volum 12 (8). ISSN 1088-4246.s 964 - 967.s doi: 10.1142/S1088424608000340.
- Roos, BO; Veryazov, V; Conradie, J; Taylor, PR; Ghosh, Abhik. Not Innocent: Verdict from Ab Initio Multiconfigurational Second-Order Perturbation Theory on the Electronic Structure of Chloroiron Corrole. Journal of Physical Chemistry B 2008; Volum 112 (45). ISSN 1520-6106.s 14099 - 14102.s doi: 10.1021/jp807734x.
- Gonzalez, Emmanuel; Ghosh, Abhik. Models of the ox1 State of Methyleoenzyme M Reductase: Where are the Electrons?. Chemistry - A European Journal 2008; Volum 14 (32). ISSN 0947-6539.s 9981 - 9989.s doi: 10.1002/chem.200800648.
- Ryeng, Hege; Gonzalez, Emmanuel; Ghosh, Abhik. DFT at Its Best: Metal- versus Ligand-Centered Reduction in Nickel Hydroporphyrins. Journal of Physical Chemistry B 2008; Volum 112 (47). ISSN 1520-6106.s 15158 - 15173.s doi: 10.1021/jp805486b.
- Kolle, Ekaney Thomas; Wasbotten, Ingar Halvorsen; Ghosh, Abhik. Copper beta-Octakis(trifluoromethyl)corroles: New Paradigms for Ligand Substituent Effects in Transition Metal Complexes. Inorganic Chemistry 2008; Volum 47 (22). ISSN 0020-1669.s 10469 - 10478.s doi: 10.1021/ic801101k.
- Tangen, Espen; Conradie, J; Ghosh, Abhik. Bonding in low-coordinate environments: Electronic structure of pseudotetrahedral iron - Imido complexes. Journal of Chemical Theory and Computation 2007; Volum 3. ISSN 1549-9618.s doi: 10.1021/ct600318n.
- Wasbotten, Ingar Halvorsen; Ghosh, Abhik. Spin-state energetics and spin-crossover behavior of pseudotetrahedral Cobalt(III)-imido complexes. The role of the tripodal supporting ligand. Inorganic Chemistry 2007; Volum 46. ISSN 0020-1669.s doi: 10.1021/ic700543f.
- Conradie, Jeanet; Ghosh, Abhik. DFT calculations on the spin-crossover complex Fe(salen)(NO): a quest for the best functional. Journal of Physical Chemistry B 2007; Volum 111. ISSN 1520-6106.
- Basu, S; Grubina, R; Huang, J; Conradie, Jeanet; Huang, Z; Jeffers, A; Jiang, A; He, X; Azarov, I; Seibert, R; Mehta, A; Patel, R; King, SB; Hogg, N; Ghosh, Abhik; Gladwin, MT; Kim-Shapiro, DB. Catalytic generation of N2O3 by the concerted nitrite reductase and anhydrase activity of hemoglobin. Nature Chemical Biology 2007; Volum 3. ISSN 1552-4450.
- Conradie, J; Ghosh, Abhik. Electronic structure of trigonal-planar transition-metal-imido complexes: Spin-state energetics, spin-density profiles, and the remarkable performance of the OLYP functional. Journal of Chemical Theory and Computation 2007; Volum 3. ISSN 1549-9618.s doi: 10.1021/ct600337j.
- Ghosh, Abhik. Electronic structure and FeNO conformation of nonheme Iron-Thiolate-NO complexes: An experimental and DFT study. Journal of the American Chemical Society 2007; Volum 129. ISSN 0002-7863.s 10446 - 10456.s doi: 10.1021/ja0719982.
- Conradie, Jeanet; Tangen, Espen; Ghosh, Abhik. Trigonal bipyramidal iron(III) and manganese(III) oxo, sulfido, and selenido complexes. An electronic-structural overview. Journal of Inorganic Biochemistry 2006; Volum 100. ISSN 0162-0134.
- Conradie, Jeanet; Ghosh, Abhik. When being straight bends rules: A rationale for the linear FeNO unit in the low-spin square-pyramidal {FeNO}(7) tetracyanonitrosylferrate(2-) anion. Journal of Inorganic Biochemistry 2006; Volum 100. ISSN 0162-0134.s 2069 - 2073.
- Ghosh, Abhik. Just how good is DFT?. JBIC Journal of Biological Inorganic Chemistry 2006; Volum 11. ISSN 0949-8257.s 671 - 673.
- Ghosh, Abhik. Transition metal spin state energetics and noninnocent systems: challenges for DFT in the bioinorganic arena. JBIC Journal of Biological Inorganic Chemistry 2006; Volum 11. ISSN 0949-8257.s 712 - 724.
- Conradie, Jeanet; Ghosh, Abhik. Iron(III)-nitro porphyrins: Theoretical exploration of a unique class of reactive molecules. Inorganic Chemistry 2006; Volum 45. ISSN 0020-1669.
- Wasbotten, Ingar Halvorsen; Ghosh, Abhik. Biliverdine-based metalloradicals: Sterically enhanced noninnocence. Inorganic Chemistry 2006; Volum 45. ISSN 0020-1669.
- Wasbotten, Ingar Halvorsen; Ghosh, Abhik. Theoretical evidence favoring true iron(V)-oxo corrole and corrolazine intermediates. Inorganic Chemistry 2006; Volum 45. ISSN 0020-1669.
- Conradie, Jeanet; Wasbotten, Ingar Halvorsen; Ghosh, Abhik. Electronic menages a trois: A molecular orbital perspective of protonated ferryl intermediates and synthetic models. Journal of Inorganic Biochemistry 2006; Volum 100. ISSN 0162-0134.
- Conradie, M. M.; Conradie, Jeanet; Ghosh, Abhik. A DFT overview of high-valent iron, cobalt and nickel tetraamidomacrocyclic ligand (TAML) complexes: The end of innocence?. Journal of Inorganic Biochemistry 2006; Volum 100. ISSN 0162-0134.s 620 - 626.
- Ghosh, Abhik; Wasbotten, Ingar Halvorsen; Davis, W; Swarts, Jannie c.. Norcorrole and dihydronorcorrole: A predictive quantum chemical study. European Journal of Inorganic Chemistry (EurJIC) 2005. ISSN 1434-1948.s 4479 - 4485.
- Ghosh, Abhik. Metalloporphyrin-NO bonding: Building bridges with organometallic chemistry. Accounts of Chemical Research 2005; Volum 38. ISSN 0001-4842.s 943 - 954.
- Ghosh, Abhik; Taylor, Peter R.. Iron(IV) porphyrin difluoride does not exist: Implications for DFT calculations on heme protein reaction pathways. Journal of Chemical Theory and Computation 2005; Volum 1. ISSN 1549-9618.s 597 - 600.
- Shao, JL; Steene, Erik; Hoffman, BM; Ghosh, Abhik. EPR, ENDOR, and DFT studies on (beta-octahalo-meso-tetraarylporphyrin)copper complexes: Characterization of the metal(d(x)(-y)(2)(2))-porphyrin(a(2u))orbital interaction. European Journal of Inorganic Chemistry (EurJIC) 2005. ISSN 1434-1948.
- Tangen, Espen; Conradie, Jeanet; Ghosh, Abhik. The Challenge of Being Straight: Explaining the Linearity of a Low-Spin {FeNO}7 Unit in a Tropocoronand Complex. Inorganic Chemistry 2005; Volum 44. ISSN 0020-1669.s 8699 - 8706.
- Tangen, Espen; Svadberg, Anders; Ghosh, Abhik. Toward Modeling H-NOX Domains: A DFT Study of Heme-NO Complexes as Hydrogen Bond Acceptors. Inorganic Chemistry 2005; Volum 44. ISSN 0020-1669.s 7802 - 7805.
- Tangen, Espen; Ghosh, Abhik. Electronic structure of cis-Mo(P)(NO)(2), where P is a porphyrin: An organometallic perspective of metalloporphyrin-NO complexes. Journal of Inorganic Biochemistry 2005; Volum 99. ISSN 0162-0134.
- Tangen, Espen; Conradie, Jeanet; Svadberg, Anders; Ghosh, Abhik. Understanding the unexpected linearity of the trans-{Mn(NO)(2)}(8) unit in a phthalocyanine complex: some thoughts on dinitrosylheme intermediates in biology. Journal of Inorganic Biochemistry 2005; Volum 99. ISSN 0162-0134.
- Wasbotten, Ingar Halvorsen; Ghosh, Abhik. Modeling Side-On NO Coordination to Type 2 Copper in Nitrite Reductase: Structures, Energetics, and Bonding. Journal of the American Chemical Society 2005; Volum 127. ISSN 0002-7863.s 15384 - 15385.
- Steene, Erik; Ghosh, Abhik; Dey, A.. Beta-Octafluorocorroles. Journal of the American Chemical Society 2004; Volum 125. ISSN 0002-7863.s 16300 - 16309.
- Ghosh, Abhik; Tangen, Espen; Ryeng, Hege; Taylor, Peter. Electronic Structure of High-Spin Iron(IV) Complexe. European Journal of Inorganic Chemistry (EurJIC) 2004. ISSN 1434-1948.s 2442 - 2445.
- Hansen, T; Ovesen, H; Svadberg, A; Svendsen, K; Tangen, Espen; Swarts, JC; Ghosh, Abhik. Unique orbital symmetry-driven cisoid tilting of the axial ligands in dialkylruthenium(IV) porphyrins. Organometallics 2004; Volum 23. ISSN 0276-7333.s 3870 - 3872.
- Conradie, J; Swarts, JC; Ghosh, Abhik. Models of high-valent heme protein intermediates: A quantum chemical study of iron(IV) porphyrins with two univalent axial pi-bonding ligands. Journal of Physical Chemistry B 2004; Volum 108. ISSN 1520-6106.s 452 - 456.
- Ghosh, Abhik; Tangen, Espen; Gonzalez, Emmanuel; Que, jr., Lawrence. Models of High-Valent Intermediates of Nonheme Diiron Alkane Monooxygenases. Electronic Structure of a Bis(mu-oxo)diron(IV) Complex with Locally Low-Spin Metal Centers. Angewandte Chemie International Edition 2004; Volum 43. ISSN 1433-7851.s 834 - 838.
- Ghosh, Abhik. A Perspective of Pyrrole-Aldehyde Condensations as Versatile Self-Assembly Processes. Angewandte Chemie International Edition 2004; Volum 43. ISSN 1433-7851.s 1918 - 1931.
- Van oort, Bart; Tangen, Espen; Ghosh, Abhik. Electronic structure of transition metal-isocorrole complexes: A first quantum chemical study. European Journal of Inorganic Chemistry (EurJIC) 2004. ISSN 1434-1948.s 2442 - 2445.
- Conradie, Jeanet; Ghosh, Abhik. Do the One-Electron Oxidized Derivatives of Some Six-Coordinate Low-Spin Iron(III) Porphyrins Feature Strong Metal-Ligand Ferromagnetic Coupling?". Journal of Physical Chemistry B 2003; Volum 107. ISSN 1520-6106.s 6486 - 6490.
- Ghosh, Abhik. Computational Bioinorganic Chemistry. Part III. The Tools of the Trade: From High-Level Ab Initio Calculations to Structural Bioinformatics (editorial). Current Opinion in Chemical Biology 2003; Volum 7. ISSN 1367-5931.s 110 - 112.
- Ghosh, Abhik; Taylor, Peter R.. High-Level Ab Initio Calculations on the Spin State Energetics of Biologically Relevant Transition Metal Complexes: A First Progress Report. Current Opinion in Chemical Biology 2003; Volum 91. ISSN 1367-5931.s 113 - 124.
- Wasbotten, Ingar Halvorsen; Conradie, Jeanet; Ghosh, Abhik. Electronic Absorption and Resonance Raman Signatures of Hyperporphyrins and Nonplanar Porphyrins. Journal of Physical Chemistry 2003; Volum 107. ISSN 0022-3654.s 3613 - 3623.
- Conradie, Jeanet; Wondimagegn, Tebikie; Ghosh, Abhik. Molecular Structure and Conformation of Dinitrosylheme. Journal of the American Chemical Society 2003; Volum 125. ISSN 0002-7863.s 4968 - 4969.
- Ghosh, Abhik; Persson, B.J.; Taylor, Peter R.. Ab Initio Multiconfiguration Reference Perturbation Theory Calculations on the Energetics of Low-Energy Spin States of Iron(III) Porphyrins. JBIC Journal of Biological Inorganic Chemistry 2003; Volum 8. ISSN 0949-8257.s 507 - 511.
- Vangberg, T. R.; Lie, Renate; Ghosh, Abhik. Symmetry-breaking phenomena in metalloporphyrin-cation radicals. Journal of the American Chemical Society 2002; Volum 124. ISSN 0002-7863.s 8122 - 8130.
- Ryeng, Hege; Ghosh, Abhik. Do non-planar distortions of porphyrins bring about strongly red-shifted electronic spectra? Controversy, consesus, new developments, and relevance to chelatases. Journal of the American Chemical Society 2002; Volum 124. ISSN 0002-7863.s 8099 - 8103.
- Dey, Abishek; Ghosh, Abhik. "True" Iron(V) and Iron(VI) porphyrins: A first theoretical exploration. Journal of the American Chemical Society 2002; Volum 124. ISSN 0002-7863.s 3206 - 3207.
- Ghosh, Abhik; Wondimagegn, Tebikie; Ryeng, Hege. Deconstructing F430: Quantum chemical perspectives of biological methanogenesis. Current Opinion in Chemical Biology 2002; Volum 5. ISSN 1367-5931.s 744 - 750.
- Tangen, Espen; Ghosh, Abhik. Electronic Structure of High-Valent Transition Metal Corrolazine Complexes. The Young and Innocent?. Journal of the American Chemical Society 2002; Volum 124. ISSN 0002-7863.s 8117 - 8121.
- Wasbotten, Ingar Halvorsen; Wondimagegn, Tebikie; Ghosh, Abhik. Electronic Absorption, Resonance Raman, and Electrochemical Studies of Planar and Saddled Copper(III) Meso-Triarylcorroles. Uniquely Substituent-Sensitive Soret Bands Specific to High-Valent Transition Metal Corroles. (data) Journal of the American Chemical Society 2002; Volum 124. ISSN 0002-7863.s 8104 - 8116.
- Ghosh, Abhik; Steene, Erik. High-valent transition metal centers versus noninnocent ligands in metallocorroles: insights from electrochemistry and implications for high-valent heme protein intermediates. Journal of Inorganic Biochemistry 2002; Volum 91. ISSN 0162-0134.s 423 - 436.
- Steene, Erik; Wondimagegn, Tebikie; Ghosh, Abhik. Resonance Raman spectroscopy and density functional theoretical calculations of manganese corroles. A parallelism between high-valent metallocorroles and metalloporphyrins, relevant to horseradish peroxidase and chloroperoxidase compound I and II intermediates. Journal of Inorganic Biochemistry 2002; Volum 88. ISSN 0162-0134.s 113 - 118.
- Ghosh, Abhik; Gonzalez, Emmanuel; Vangberg, T. R.; Taylor, Peter R.. 1950-2000: 50 years of theoretical research on porphyrins. Journal of Porphyrins and Phthalocyanines 2001; Volum 5. ISSN 1088-4246.s 187 - 189.
- Ghosh, Abhik; Moulder, J.; Broring, Martin; Vogel, Emmanuel. X-ray photoelectron spectroscopy of porphycenes: Charge asymmetry across low-barrier hydrogen bonds. Angewandte Chemie International Edition 2001; Volum 113. ISSN 1433-7851.s 431 - 434.
- Wondimagegn, Tebikie; Ghosh, Abhik. Theoretical modeling of putative Ni(III)-F430 intermediates of Methylcoenzyme M Reductase. Journal of the American Chemical Society 2001; Volum 123. ISSN 0002-7863.s 1543 - 1544.
- Ghosh, Abhik; Gonzalez, Emmanuel; Vangberg, T. R.; Taylor, Peter R.. Molecular structures and electron distribution of higher-valent iron and manganese porphyrins. Density Functional Theory calculations and some preliminary Coupled-Cluster results. Journal of Porphyrins and Phthalocyanines 2001; Volum 5. ISSN 1088-4246.s 345 - 356.
- Wondimagegn, Tebikie; Ghosh, Abhik. A quantum chemical survey of metalloporphyrin-nitrosyl linkage isomers: Insights into the observation of multiple FeNO conformations in a recent chrystallographic dertermination of Nitrophorin 4. Journal of the American Chemical Society 2001; Volum 123. ISSN 0002-7863.s 5680 - 5683.
- Steene, Erik; Wondimagegn, Tebikie; Ghosh, Abhik. Electrochemical and Electronic Absorption Spectroscopic Studies of Substituent Effects in Iron(IV) and Manganese(IV) Corroles. Do the Compounds Feature High-Valent Metal Centers or Noninnocent Corrole Ligands? Implications for Peroxidase Compound I and II Intermediates. Journal of Physical Chemistry B 2001; Volum 105. ISSN 1520-6106.s 11406 - 11413.
- Halvorsen, Ingar; Steene, Erik; Ghosh, Abhik. Resonance Raman marker bands of beta-octahalogeno-meso-tetraarylmetalloporphyrins. Journal of Porphyrins and Phthalocyanines 2001; Volum 5. ISSN 1088-4246.s 721 - 730.
- Ghosh, Abhik; Halvorsen, Ingar; Nilsen, Henning J.; Steene, Erik; Wondimagegn, Tebikie; Lie, Renate; Van Caemelbecke, E; Guo, N; Ou, Z; Kadish, Karl M. Electrochemistry of Nickel and Copper beta-Octahalogeno-meso-tetraarylporphyrins. Evidence for Important Role Played by Saddling-Induced Metal(dx2-y2)-Porphyrin("a2u") Orbital Interactions. Journal of Physical Chemistry B 2001; Volum 105. ISSN 1520-6106.s 8120 - 8124.
- Ghosh, Abhik; Steene, Erik. High-valent transition metal centers and noninnocent ligands in metalloporphyrins and related molecules: a broad overview based on quantum chemical calculations. JBIC Journal of Biological Inorganic Chemistry 2001; Volum 6. ISSN 0949-8257.s 739 - 752.
- Ghosh, Abhik. Local symmetry and chirality of molecular faces. Theoretical Chemistry Accounts 2000; Volum 104. ISSN 1432-881X.s 157 - 159.
- Wondimagegn, Tebikie; Ghosh, Abhik. Ruffling deformations of Nickel(II) and Zinc(II) hydroporphyrin and chlorophin complexes: Implications for F430, the nickel tetrapyrrole cofactor of Methylcoenzyme M Reductase. Journal of Physical Chemistry B 2000; Volum 104. ISSN 1520-6106.s 10858 - 10862.
- Wondimagegn, Tebikie; Ghosh, Abhik. A first-principle quantum chemical study of coenzyme F430: Interplay of skeletal stereoisomerism and conformation in the stabilization of Nickel(I). Journal of the American Chemical Society 2000; Volum 122. ISSN 0002-7863.s 6375 - 6381.
- Ghosh, Abhik; Gonzalez, Emmanuel. Theoretical Studies on high-valent manganese porphyrins: Toward a deeper understanding of energetics, electron distribution, and structural features of the reactive intermediates of enzymatic and synthetic manganese-catalyzed oxidative processes. Israel Journal of Chemistry (IJC) 2000; Volum 40. ISSN 0021-2148.s 1 - 8.
- Ghosh, Abhik; Wondimagegn, Tebikie. A theoretical study of axial tilting and equatorial asymmetry in metalloporphyrin-nitrosyl complexes. Journal of the American Chemical Society 2000; Volum 122. ISSN 0002-7863.s 8101 - 8102.
- Parusel, A. B. J.; Wondimagegn, Tebikie; Ghosh, Abhik. Do nonplanar porphyrins have red-shifted electronic spectra? A DFT/SCI study and reinvestigation of a recent proposal. Journal of the American Chemical Society 2000; Volum 122. ISSN 0002-7863.s 6371 - 6374.
- Parusel, A. B. J.; Ghosh, Abhik. Density Functional Theory based Configuration Interaction calculations on the electronic spectra of porphyrin, chlorin, bacteriochlorin, and cis- and trans-isobacteriochlorin. Journal of Physical Chemistry A 2000; Volum 104. ISSN 1089-5639.s 2504 - 2507.
- Wondimagegn, Tebikie; Ghosh, Abhik. Conformational Flexibility of Mesotetrakis (perfluoroalkyl) porphyrins: Energetics of ruffling versus saddling. Journal of Physical Chemistry A 2000; Volum 104. ISSN 1089-5639.s 4606 - 4608.
- Ghosh, Abhik; Wondimagegn, Tebikie; Gonzalez, E.; Halvorsen, I.. Valence tautomerism and macrocycle ruffling in high-valent nickel(III) porphyrins. Journal of Inorganic Biochemistry 2000; Volum 78. ISSN 0162-0134.s 79 - 82.
- Ghosh, Abhik; Wondimagegn, Tebikie; Parusel, A.. Electronic structure of gallium, copper, and nickel complexes of corrole. High-valent transition metals versus noninnocent ligands. Journal of the American Chemical Society 2000; Volum 122. ISSN 0002-7863.s 5100 - 5104.
- Ghosh, Abhik; Gonzalez, E.; Vangberg, T.. Theoretical studies of low-spin six-coordinate iron (III) porphyrins relevant to cytochromes b: Variable electronic configurations, ligand noninnocence, and macrocycle ruffling. Journal of Physical Chemistry B 1999; Volum 103. ISSN 1520-6106.s 1363 - 1367.
- Ghosh, Abhik. Quantum Chemical Studies of Molecular Structures and Potential Energy Surfaces of Porphyrins and Hemes. Academic Press 1999 ISBN 0123932009.s 1 - 38.
- Vangberg, T.; Ghosh, Abhik. A first-principles quantum chemical analysis of the factors controlling ruffling deformations of porphyrins. Insights from the molecular structures and potential energy surfaces of silicon, phosphorus, germa-nium, and arsenic porphyrins. Journal of the American Chemical Society 1999; Volum 121. ISSN 0002-7863.s 12154 - 12160.
- Ghosh, Abhik; Vangberg, T.. Comparative Thermochemistry of Metalloporphyrin Isomers as a Function of Metal Ion Size. A Possible Insight into Nature's Choice of Porphyrin over Isomeric Ligands. Inorganic Chemistry 1998; Volum 37. ISSN 0020-1669.s 6276 - 6280.
- Ghosh, Abhik; Wondimagegn, Tebikie; Nilsen, Henning J.. Molecular sttructures, tautomerism, amd carbon nucleophilicity of free-base inverted porphyrins and carbaporphyrins: A density Functional Theoretical study. Journal of Physical Chemistry B 1998; Volum 102. ISSN 1520-6106.s 10459 - 10467.
- Ghosh, Abhik. Modern First-Principles Quantum Chemical Studies of Porphyrins. Accounts of Chemical Research 1998; Volum 31. ISSN 0001-4842.s 189 - 198.
- Nilsen, H.; Ghosh, Abhik. Highlights of Carbaporphyrin Chemistry. Acta Chemica Scandinavica 1998; Volum 52. ISSN 0904-213X.s 827 - 830.
- Ghosh, Abhik; Skancke, A.. Revisiting the Putative Ferryl Bending Mode of Oxidized Cytochrome c Oxidase with Density Functional Vibrational Analyses of Model Complexes. Journal of Physical Chemistry B 1998; Volum 102. ISSN 1520-6106.s 10087 - 10090.
- Vangberg, T.; Ghosh, Abhik. Direct porphyrin-aryl orbital overlaps in some meso-tetraarylporphyrins. Journal of the American Chemical Society 1998; Volum 120 (25). ISSN 0002-7863.s 6227 - 6230.
- Ghosh, Abhik; Jynge, K.. Cis-Trans Isomerism in Porphyrin Isomers. Journal of Physical Chemistry 1997; Volum 101. ISSN 0022-3654.s 5459 - 5462.
- Vangberg, T. R.; Ghosh, Abhik. Monodeprotonated free-base porphyrin. Journal of Physical Chemistry B 1997; Volum 101. ISSN 1520-6106.s 1496 - 1497.
- Ghosh, Abhik; Vangberg, T.. Valence Ionization Potentials and Cation Radicals of Prototype Porphyrins. The Remarkable Performance of Nonlocal Density Functional Theory.". Theoretical Chemistry Accounts 1997; Volum 97. ISSN 1432-881X.s 143 - 149.
- Vangberg, T.; Bocian, D.; Ghosh, Abhik. Deformability of Fe(II)CO and Fe(III)CN Groups in Heme Protein Models; Non-local Density Functional Theory Calculations. JBIC Journal of Biological Inorganic Chemistry 1997; Volum 2. ISSN 0949-8257.s 526 - 530.
- Ghosh, Abhik. A Theoretical Comparative Study of Free-Base Porphyrin, Chlorin, Bacteriochlorin, and Isobacteriochlorin Evaluation of the Potential Roles of Ab Initio Hartree-Fock and Density Functional Theories in Hydroporphyrin Chemistry". Journal of Physical Chemistry B 1997; Volum 101. ISSN 1520-6106.s 3290 - 3297.
- Ghosh, Abhik; Almlöf, J; Que, Larry Jr.. Electronic structure of non-heme iron-oxo complexes containing the unprecedented high-valent [Fe2(-O)2]3+ core. Angewandte Chemie International Edition 1996; Volum 35. ISSN 1433-7851.s 770 - 772.
- Ghosh, Abhik. A comparison of ortho, meta, and para substituent effects in tetraphenylporphyrins: insights into the nature of the porphyrin-phenyl electronic interaction. Journal of Molecular Structure: THEOCHEM 1996; Volum 388. ISSN 0166-1280.s 359 - 363.
- Goll, J. G.; Moore, K. T.; Ghosh, Abhik; Therien, M. J.. Synthesis, structure, electrochemistry, Xray photoelectron spectroscopy, and photophysics of highly electron-deficient free base and Zinc-complexed 5,10,15,20-tetrakis(perfluoroalkyl)porphyrins. Journal of the American Chemical Society 1996; Volum 118. ISSN 0002-7863.s 8344 - 8354.
- Ghosh, Abhik; Bocian, D. F.. The carbonyl tilting and bending potential energy surface of carbonmonoxyhemes. Journal of Physical Chemistry 1996; Volum 100. ISSN 0022-3654.s 6363 - 6367.
- Ghosh, Abhik; Almlöf, J.. Structure and stability of Cis-porphyrin. Journal of Physical Chemistry 1995; Volum 99. ISSN 0022-3654.s 1073 - 1075.
- Kalsbeck, W. A.; Ghosh, Abhik; Pandey, R. K.; Smith, K. M.; Bocian, D. F.. Determinants of vinyl streching frequencies of protoporphyrins. Implications for cofactor-protein interactions. Journal of the American Chemical Society 1995; Volum 117. ISSN 0002-7863.s 10959 - 10968.
- Ghosh, Abhik. Substituent effects on valence ionization potentials of free base porphyrins: Local Density Functional Calculations and their relevance to electrochemical and photoelectron spectroscopic studies. Journal of the American Chemical Society 1995; Volum 117. ISSN 0002-7863.s 4691 - 4699.
- Ghosh, Abhik. N-confused porphyrins and singlet carbenes: Is there a connection?. Angewandte Chemie International Edition 1995; Volum 34. ISSN 1433-7851.s 1028 - 1030.
- Ghosh, Abhik; Gassman, Paul G.; Almlöf, J. Substituent effects in porphyrazines and phtalocyanines. Journal of the American Chemical Society 1994; Volum 116. ISSN 0002-7863.s 1932 - 1940.
- Ghosh, Abhik; Fitzgerald, J.; Gassman, Paul G.; Almlöf, J. Electronic distinction between porphyrins and tetraazaporphyrins: X-ray photoelectron spectra of free base porphyrin, porphyrazine, and phtalocyanine ligands. Inorganic Chemistry 1994; Volum 33. ISSN 0020-1669.s 6057 - 6060.
- Ghosh, Abhik. Ab Initio Hartree-Fock and local density functional calculations on halogenated porphyrins. Do electrochemically measured substituent effects reflect gas-phase trends?. Journal of Physical Chemistry 1994; Volum 98. ISSN 0022-3654.s 11004 - 11006.
- Ghosh, Abhik; Almlöf, J; Que, Larry Jr. Density Functional Calculations on Oxo(porphyrinato)Iron(IV) complexes, models of peroxidase compounds I and II. Journal of Physical Chemistry 1994; Volum 98. ISSN 0022-3654.s 5576 - 5579.
- Ghosh, Abhik; Almlöf, J.. The ultraviolet photoelectron spectrum of free-base porphyrin revisited. On the performance of density functional theory. Chemical Physics Letters 1993; Volum 213. ISSN 0009-2614.s 519 - 521.
- Ghosh, Abhik. X-ray photoelectron spectral characterization of the extremely electron-deficient nature of octakis(N,N-diethylcarboxamido)porphyrin. Journal of Organic Chemistry 1993; Volum 58. ISSN 0022-3263.s 6932 - 6932.
- Almlöf, J.; Fischer, T. H.; Gassman, Paul G.; Ghosh, Abhik; Haser, M.. Electron correlation in tetrapyrroles. Ab initio calculations on porphyrins and the tautomers of chlorin. Journal of Physical Chemistry 1993; Volum 97. ISSN 0022-3654.s 10964 - 10970.
- Gassman, Paul G.; Ghosh, Abhik; Almlöf, J. Substituent effects in porphyrins. X-ray photoelectron spectroscopy and ab inition self-consistent field calculations. Journal of the American Chemical Society 1992; Volum 114. ISSN 0002-7863.s 9990 - 10000.
- Ghosh, Abhik; Almlöf, J.; Gassman, Paul G.. Ab initio SCF Studies of Basis Set Effects in Porphin. Chemical Physics Letters 1991; Volum 186. ISSN 0009-2614.s 113 - 118.