Publications by authors named "JR Sabin"

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Influence of the ligand-field on EPR parameters of cis- and trans-isomers in Mo systems relevant to molybdenum enzymes: Experimental and density functional theory study.
Victor N Nemykin, Jared R Sabin, Brian W Kail, Anup Upadhyay, Michael P Hendrich

J Inorg Biochem· August 2023

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Similar, Yet Different: Long-Range Metal-Metal Coupling and Electron-Transfer Processes in Metal-Free 5,10,15,20-Tetra(ruthenocenyl)porphyrin.
Andrea Vecchi, Jared R Sabin, Federica Sabuzi, Valeria Conte, Daniel Oscar Cicero

Inorg Chem· June 2021

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Simultaneous Prediction of the Energies of Q and Q Bands and Intramolecular Charge-Transfer Transitions in Benzoannulated and Non-Peripherally Substituted Metal-Free Phthalocyanines and Their Analogues: No Standard TDDFT Silver Bullet Yet.
Rodion V Belosludov, Dustin Nevonen, Hannah M Rhoda, Jared R Sabin, Victor N Nemykin

J Phys Chem A· January 2019

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Z-dependence of mean excitation energies for second and third row atoms and their ions.
Stephan P A Sauer, John R Sabin, Jens Oddershede

J Chem Phys· May 2018

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Magnetic Circular Dichroism Spectroscopy of meso-Tetraphenylporphyrin-Derived Hydroporphyrins and Pyrrole-Modified Porphyrins.
Hannah M Rhoda, Joshua Akhigbe, Junichi Ogikubo, Jared R Sabin, Christopher J Ziegler

J Phys Chem A· July 2016

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Electronic properties of mono-substituted tetraferrocenyl porphyrins in solution and on a gold surface: assessment of the influencing factors for photoelectrochemical applications.
Andrea Vecchi, Nathan R Erickson, Jared R Sabin, Barbara Floris, Valeria Conte

Chemistry· January 2015

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Quantum nuclear extension of electron nuclear dynamics on folded effective-potential surfaces.
Benjamin Hall, Erik Deumens, Yngve Öhrn, John R Sabin

J Phys Chem A· August 2014

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Synthesis, characterization, and electron-transfer processes in indium ferrocenyl-containing porphyrins and their fullerene adducts.
Samantha J Dammer, Pavlo V Solntsev, Jared R Sabin, Victor N Nemykin

Inorg Chem· August 2013

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Unexpected formation of chiral pincer CNN nickel complexes with β-diketiminato type ligands via C-H activation: synthesis, properties, structures, and computational studies.
Zhengliang Lu, Srinivas Abbina, Jared R Sabin, Victor N Nemykin, Guodong Du

Inorg Chem· February 2013

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Insight into the electronic structure, optical properties, and redox behavior of the hybrid phthalocyaninoclathrochelates from experimental and density functional theory approaches.
Jared R Sabin, Oleg A Varzatskii, Yan Z Voloshin, Zoya A Starikova, Valentin V Novikov

Inorg Chem· August 2012

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Profiling energetics and spectroscopic signatures in prototropic tautomers of asymmetric phthalocyanine analogues.
Victor N Nemykin, Jared R Sabin

J Phys Chem A· July 2012

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Photoinduced charge transfer in short-distance ferrocenylsubphthalocyanine dyads.
Pavlo V Solntsev, Katelynn L Spurgin, Jared R Sabin, Ahmed A Heikal, Victor N Nemykin

Inorg Chem· June 2012

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The first TDDFT and MCD studies of free base triarylcorroles: a closer look into solvent-dependent UV-visible absorption.
Christopher J Ziegler, Jared R Sabin, G Richard Geier, Victor N Nemykin

Chem Commun (Camb)· May 2012

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Unexpected fluorescence properties in an axially sigma-bonded ferrocenyl-containing porphyrin.
Pavlo V Solntsev, Jared R Sabin, Samantha J Dammer, Nikolay N Gerasimchuk, Victor N Nemykin

Chem Commun (Camb)· September 2010

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Long-range electronic communication in free-base meso-poly(ferrocenyl)-containing porphyrins.
Victor N Nemykin, Gregory T Rohde, Christopher D Barrett, Ryan G Hadt, Jared R Sabin

Inorg Chem· August 2010

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Mean excitation energies and energy deposition characteristics of bio-organic molecules.
Shakeela Bruun-Ghalbia, Stephan P A Sauer, Jens Oddershede, John R Sabin

J Phys Chem B· January 2010

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Construction of basis sets for time-dependent studies.
N L Guevara, B Hall, E Teixeira, J R Sabin, E Deumens

J Chem Phys· August 2009

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Strong isotope effects on the charge transfer in slow collisions of He2+ with atomic hydrogen, deuterium, and tritium.
N Stolterfoht, R Cabrera-Trujillo, Y Ohrn, E Deumens, R Hoekstra, J R Sabin

Phys Rev Lett· September 2007

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Directional dependence of the mean excitation energy and spectral moments of the dipole oscillator strength distribution of glycine and its zwitterion.
Stephan P A Sauer, Jens Oddershede, John R Sabin

J Phys Chem A· July 2006

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Charge exchange and threshold effect in the energy loss of slow projectiles.
R Cabrera-Trujillo, JR Sabin, Y Ohrn, E Deumens

Phys Rev Lett· June 2000

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Relativistic extension of the Bethe sum rule.
GA Aucar, J Oddershede, JR Sabin

Phys Rev A· August 1995

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Calculated properties of a prototypical ionic monolayer.
JZ Wu, SB Trickey, JR Sabin, JC Boettger

Phys Rev B Condens Matter· May 1995

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Directional characteristics of the moments of the dipole-oscillator-strength distribution of molecules: H2 and H2O.
SP Sauer, JR Sabin, J Oddershede

Phys Rev A· February 1993

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Structure, energetics, and molecular- to atomic-ordering transitions in hydrogen thin films.
JZ Wu, SB Trickey, JR Sabin, JC Boettger

Phys Rev B Condens Matter· April 1992

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Geometric dependence of the mean excitation energy and spectral moments of water.
P Jensen, J Oddershede, JR Sabin

Phys Rev A· April 1991

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