Filipp Furche

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 53

Top Topics

Benign Prostatic Hyperplasia

Density Functional Theory

Crystal Structure

Top Venues

Journal of the American Chemical Society

Inorganic chemistry

Journal of chemical theory and computation

The journal of physical chemistry. A

This page only lists publications with an associated author ORCID identifier.

Publications

Joseph Q Nguyen, Justin C Wedal, Joseph W Ziller, Filipp Furche, William J Evans
Investigating Steric and Electronic Effects in the Synthesis of Square Planar 6d 1 Th(III) Complexes. Inorganic chemistry (2024)
Joshua D Queen, Lauren M Anderson-Sanchez, Cary R Stennett, Ahmadreza Rajabi, Joseph W Ziller, Filipp Furche, William J Evans
Synthesis of Crystallographically Characterizable Bis(cyclopentadienyl) Sc(II) Complexes: (C 5 H 2 t Bu 3 ) 2 Sc and {[C 5 H 3 (SiMe 3 ) 2 ] 2 ScI} 1 . Journal of the American Chemical Society (2024)
Robin Grotjahn, Justin Purnomo, Dayun Jin, Nicolas Lutfi, Filipp Furche
Chemically Accurate Singlet-Triplet Gaps of Arylcarbenes from Local Hybrid Density Functionals. The journal of physical chemistry. A (2024)
Joshua D Queen, Lauren M Anderson-Sanchez, Cary R Stennett, Ahmadreza Rajabi, Joseph W Ziller, Filipp Furche, William J Evans
Synthesis of Crystallographically Characterizable Bis(cyclopentadienyl) Sc(II) Complexes: (C 5 H 2 t Bu 3 ) 2 Sc and {[C 5 H 3 (SiMe 3 ) 2 ] 2 ScI} 1 . Journal of the American Chemical Society 146 (5) (2024)
Robin Grotjahn, Justin Purnomo, Dayun Jin, Nicolas Lutfi, Filipp Furche
Chemically Accurate Singlet-Triplet Gaps of Arylcarbenes from Local Hybrid Density Functionals. The journal of physical chemistry. A 128 (29) (2024)
Joshua D Queen, Ahmadreza Rajabi, Quinn E Goudzwaard, Qiong Yuan, Dang Khoa Nguyen, Joseph W Ziller, Filipp Furche, Zhen-Feng Xi, William J Evans
Dinitrogen reduction chemistry with scandium provides a complex with two side-on (N[double bond, length as m-dash]N) 2- ligands bound to one metal: (C 5 Me 5 )Sc[(µ-η 2 :η 2 -N 2 )Sc(C 5 Me 5 ) 2 ] 2 . Chemical science (2024)
Kito Gilbert-Bass, Cary R Stennett, Robin Grotjahn, Joseph W Ziller, Filipp Furche, William J Evans
Exploring sulfur donor atom coordination chemistry with La(II), Nd(II), and Tm(II) using a terphenylthiolate ligand. Chemical communications (Cambridge, England) (2024)
Kito Gilbert-Bass, Cary R Stennett, Robin Grotjahn, Joseph W Ziller, Filipp Furche, William J Evans
Exploring sulfur donor atom coordination chemistry with La(II), Nd(II), and Tm(II) using a terphenylthiolate ligand. Chemical communications (Cambridge, England) 60 (34) (2024)
Joseph Q Nguyen, Justin C Wedal, Joseph W Ziller, Filipp Furche, William J Evans
Investigating Steric and Electronic Effects in the Synthesis of Square Planar 6d 1 Th(III) Complexes. Inorganic chemistry (2024)
Joshua D Queen, Quinn E Goudzwaard, Ahmadreza Rajabi, Joseph W Ziller, Filipp Furche, William J Evans
The Scandium(II) Carbonyl Complex (C 5 H 2 t Bu 3 ) 2 Sc(CO) and Its Isocyanide Analog (C 5 H 2 t Bu 3 ) 2 Sc(CNC 6 H 3 Me 2 -2,6). Journal of the American Chemical Society (2024)
Kito Gilbert-Bass, Cary R Stennett, Robin Grotjahn, Joseph W Ziller, Filipp Furche, William J Evans
Exploring sulfur donor atom coordination chemistry with La(II), Nd(II), and Tm(II) using a terphenylthiolate ligand. Chemical communications (Cambridge, England) 60 (34) (2024)
Joseph Q Nguyen, Justin C Wedal, Joseph W Ziller, Filipp Furche, William J Evans
Investigating Steric and Electronic Effects in the Synthesis of Square Planar 6d 1 Th(III) Complexes. Inorganic chemistry 63 (14) (2024)
Robin Grotjahn, Justin Purnomo, Dayun Jin, Nicolas Lutfi, Filipp Furche
Chemically Accurate Singlet-Triplet Gaps of Arylcarbenes from Local Hybrid Density Functionals. The journal of physical chemistry. A 128 (29) (2024)
Lauren M Anderson-Sanchez, Jason M Yu, Joseph W Ziller, Filipp Furche, William J Evans
Room-Temperature Stable Ln(II) Complexes Supported by 2,6-Diadamantyl Aryloxide Ligands. Inorganic chemistry (2023)
Lauren M Anderson-Sanchez, Jason M Yu, Joseph W Ziller, Filipp Furche, William J Evans
Room-Temperature Stable Ln(II) Complexes Supported by 2,6-Diadamantyl Aryloxide Ligands. Inorganic chemistry 62 (2) (2023)
Dmitrij Rappoport, Samuel Bekoe, Luke Nambi Mohanam, Scott Le, Naje' George, Ziyue Shen, Filipp Furche
Libkrylov: A modular open-source software library for extremely large on-the-fly matrix computations. Journal of computational chemistry 44 (11) (2023)
Robin Grotjahn, Filipp Furche
Gauge-Invariant Excited-State Linear and Quadratic Response Properties within the Meta-Generalized Gradient Approximation. Journal of chemical theory and computation (2023)
Dmitrij Rappoport, Samuel Bekoe, Luke Nambi Mohanam, Scott Le, Naje' George, Ziyue Shen, Filipp Furche
Libkrylov: A modular open-source software library for extremely large on-the-fly matrix computations. Journal of computational chemistry (2023)
Ahmadreza Rajabi, Robin Grotjahn, Dmitrij Rappoport, Filipp Furche
A DFT perspective on organometallic lanthanide chemistry. Dalton transactions (Cambridge, England : 2003) (2023)
Yannick J Franzke, Christof Holzer, Josefine H Andersen, Tomislav Begušić, Florian Bruder, Sonia Coriani, Fabio Della Sala, Eduardo Fabiano, Daniil A Fedotov, Susanne Fürst, Sebastian Gillhuber, Robin Grotjahn, Martin Kaupp, Max Kehry, Marjan Krstić, Fabian Mack, Sourav Majumdar, Brian D Nguyen, Shane M Parker, Fabian Pauly, Ansgar Pausch, Eva Perlt, Gabriel S Phun, Ahmadreza Rajabi, Dmitrij Rappoport, Bibek Samal, Tim Schrader, Manas Sharma, Enrico Tapavicza, Robert S Treß, Vamsee K Voora, Artur Wodyński, Jason M Yu, Benedikt Zerulla, Filipp Furche, Christof Hättig, Marek Sierka, David P Tew, Florian Weigend
TURBOMOLE: Today and Tomorrow. Journal of chemical theory and computation (2023)
Gabriel S Phun, Dmitrij Rappoport, Filipp Furche, Tammie R Gibson, Sergei Tretiak
Constructing the Mechanism of Dinoflagellate Luciferin Bioluminescence Using Computation. The journal of physical chemistry letters (2023)
Justin C Wedal, Joseph W Ziller, Filipp Furche, William J Evans
Synthesis and Reduction of Heteroleptic Bis(cyclopentadienyl) Uranium(III) Complexes. Inorganic chemistry 61 (19) (2022)
Krishnendu Kundu, Jessica R K White, Samuel A Moehring, Jason M Yu, Joseph W Ziller, Filipp Furche, William J Evans, Stephen Hill
A 9.2-GHz clock transition in a Lu(II) molecular spin qubit arising from a 3,467-MHz hyperfine interaction. Nature chemistry 14 (4) (2022)
William N G Moore, Jessica R K White, Justin C Wedal, Filipp Furche, William J Evans
Reduction of Rare-Earth Metal Complexes Induced by γ Irradiation. Inorganic chemistry 61 (44) (2022)
Amanda B Chung, Dmitrij Rappoport, Joseph W Ziller, Roger E Cramer, Filipp Furche, William J Evans
Solid-State End-On to Side-On Isomerization of (N═N) 2- in {[(R 2 N) 3 Nd] 2 N 2 } 2- (R = SiMe 3 ) Connects In Situ Ln III (NR 2 ) 3 /K and Isolated [Ln II (NR 2 ) 3 ] 1- Dinitrogen Reduction. Journal of the American Chemical Society 144 (37) (2022)
Conrad A P Goodwin, Sierra R Ciccone, Samuel Bekoe, Sourav Majumdar, Brian L Scott, Joseph W Ziller, Andrew J Gaunt, Filipp Furche, William J Evans
2.2.2-Cryptand complexes of neptunium(III) and plutonium(III). Chemical communications (Cambridge, England) 58 (7) (2022)
Daniel N Huh, Jared P Bruce, Sree Ganesh Balasubramani, Sierra R Ciccone, Filipp Furche, John C Hemminger, William J Evans
High-Resolution X-ray Photoelectron Spectroscopy of Organometallic (C5H4SiMe3)3LnIII and [(C5H4SiMe3)3LnII]1- Complexes (Ln = Sm, Eu, Gd, Tb). Journal of the American Chemical Society 143 (40) (2021)
Jared P Bruce, Kimberly Zhang, Sree Ganesh Balasubramani, Amanda R Haines, Randima P Galhenage, Vamsee K Voora, Filipp Furche, John C Hemminger
Exploring the Solvation of Acetic Acid in Water Using Liquid Jet X-ray Photoelectron Spectroscopy and Core Level Electron Binding Energy Calculations. The journal of physical chemistry. B 125 (31) (2021)
Justin C Wedal, Filipp Furche, William J Evans
Density Functional Theory Analysis of the Importance of Coordination Geometry for 5f36d1 versus 5f4 Electron Configurations in U(II) Complexes. Inorganic chemistry 60 (21) (2021)
Lucy E Darago, Monica D Boshart, Brian D Nguyen, Eva Perlt, Joseph W Ziller, Wayne W Lukens, Filipp Furche, William J Evans, Jeffrey R Long
Strong Ferromagnetic Exchange Coupling and Single-Molecule Magnetism in MoS43--Bridged Dilanthanide Complexes. Journal of the American Chemical Society 143 (22) (2021)
Austin J Ryan, Sree Ganesh Balasubramani, Joseph W Ziller, Filipp Furche, William J Evans
Formation of the End-on Bound Lanthanide Dinitrogen Complexes [(R2N)3Ln-N═N-Ln(NR2)3]2- from Divalent [(R2N)3Ln]1- Salts (R = SiMe3). Journal of the American Chemical Society 142 (20) (2020)
Brian D Nguyen, Guo P Chen, Matthew M Agee, Asbjörn M Burow, Matthew P Tang, Filipp Furche
Divergence of Many-Body Perturbation Theory for Noncovalent Interactions of Large Molecules. Journal of chemical theory and computation 16 (4) (2020)
Daniel N Huh, Sierra R Ciccone, Samuel Bekoe, Saswata Roy, Joseph W Ziller, Filipp Furche, William J Evans
Synthesis of LnII -in-Cryptand Complexes by Chemical Reduction of LnIII -in-Cryptand Precursors: Isolation of a NdII -in-Cryptand Complex. Angewandte Chemie (International ed. in English) 59 (37) (2020)
Justin C Wedal, Samuel Bekoe, Joseph W Ziller, Filipp Furche, William J Evans
In search of tris(trimethylsilylcyclopentadienyl) thorium. Dalton transactions (Cambridge, England : 2003) 48 (44) (2019)
Jason M Yu, Filipp Furche
Theoretical Study of Divalent Bis(Pentaisopropylcyclopentadienyl) Actinocenes. Inorganic chemistry 58 (23) (2019)
Daniel N Huh, Saswata Roy, Joseph W Ziller, Filipp Furche, William J Evans
Isolation of a Square-Planar Th(III) Complex: Synthesis and Structure of [Th(OC6H2tBu2-2,6-Me-4)4]1. Journal of the American Chemical Society 141 (32) (2019)
Saswata Roy, Shane Ardo, Filipp Furche
5-Methoxyquinoline Photobasicity Is Mediated by Water Oxidation. The journal of physical chemistry. A 123 (31) (2019)
Colin A Gould, K Randall McClain, Jason M Yu, Thomas J Groshens, Filipp Furche, Benjamin G Harvey, Jeffrey R Long
Synthesis and Magnetism of Neutral, Linear Metallocene Complexes of Terbium(II) and Dysprosium(II). Journal of the American Chemical Society 141 (33) (2019)
Adeayo O Ajala, Vamsee Voora, Narbe Mardirossian, Filipp Furche, Francesco Paesani
Assessment of Density Functional Theory in Predicting Interaction Energies between Water and Polycyclic Aromatic Hydrocarbons: from Water on Benzene to Water on Graphene. Journal of chemical theory and computation 15 (4) (2019)
Shane M Parker, Saswata Roy, Filipp Furche
Multistate hybrid time-dependent density functional theory with surface hopping accurately captures ultrafast thymine photodeactivation. Physical chemistry chemical physics : PCCP 21 (35) (2019)
Vamsee K Voora, Randima Galhenage, John C Hemminger, Filipp Furche
Effective one-particle energies from generalized Kohn-Sham random phase approximation: A direct approach for computing and analyzing core ionization energies. The Journal of chemical physics 151 (13) (2019)
Robin Grotjahn, Filipp Furche, Martin Kaupp
Development and Implementation of Excited-State Gradients for Local Hybrid Functionals. Journal of chemical theory and computation 15 (10) (2019)
Miles Kubota, Sarah Nainar, Shane M Parker, Whitney England, Filipp Furche, Robert C Spitale
Expanding the Scope of RNA Metabolic Labeling with Vinyl Nucleosides and Inverse Electron-Demand Diels-Alder Chemistry. ACS chemical biology 14 (8) (2019)
Chad T Palumbo, Dominik P Halter, Vamsee K Voora, Guo P Chen, Alan K Chan, Megan E Fieser, Joseph W Ziller, Wolfgang Hieringer, Filipp Furche, Karsten Meyer, William J Evans
Metal versus Ligand Reduction in Ln3+ Complexes of a Mesitylene-Anchored Tris(Aryloxide) Ligand. Inorganic chemistry 57 (5) (2018)
Guo P Chen, Matthew M Agee, Filipp Furche
Performance and Scope of Perturbative Corrections to Random-Phase Approximation Energies. Journal of chemical theory and computation 14 (11) (2018)
Chad T Palumbo, Dominik P Halter, Vamsee K Voora, Guo P Chen, Joseph W Ziller, Milan Gembicky, Arnold L Rheingold, Filipp Furche, Karsten Meyer, William J Evans
Using Diamagnetic Yttrium and Lanthanum Complexes to Explore Ligand Reduction and C-H Bond Activation in a Tris(aryloxide)mesitylene Ligand System. Inorganic chemistry 57 (20) (2018)
Megan E Fieser, Chad T Palumbo, Henry S La Pierre, Dominik P Halter, Vamsee K Voora, Joseph W Ziller, Filipp Furche, Karsten Meyer, William J Evans
Comparisons of lanthanide/actinide +2 ions in a tris(aryloxide)arene coordination environment. Chemical science 8 (11) (2017)
Shane M Parker, Dmitrij Rappoport, Filipp Furche
Quadratic Response Properties from TDDFT: Trials and Tribulations. Journal of chemical theory and computation 14 (2) (2017)
David H Woen, Guo P Chen, Joseph W Ziller, Timothy J Boyle, Filipp Furche, William J Evans
End-On Bridging Dinitrogen Complex of Scandium. Journal of the American Chemical Society 139 (42) (2017)
Ryan R Langeslay, Guo P Chen, Cory J Windorff, Alan K Chan, Joseph W Ziller, Filipp Furche, William J Evans
Synthesis, Structure, and Reactivity of the Sterically Crowded Th3+ Complex (C5Me5)3Th Including Formation of the Thorium Carbonyl, [(C5Me5)3Th(CO)][BPh4]. Journal of the American Chemical Society 139 (9) (2017)
Cory J Windorff, Guo P Chen, Justin N Cross, William J Evans, Filipp Furche, Andrew J Gaunt, Michael T Janicke, Stosh A Kozimor, Brian L Scott
Identification of the Formal +2 Oxidation State of Plutonium: Synthesis and Characterization of {PuII[C5H3(SiMe3)2]3}<sup/>. Journal of the American Chemical Society 139 (11) (2017)
David H Woen, Guo P Chen, Joseph W Ziller, Timothy J Boyle, Filipp Furche, William J Evans
Solution Synthesis, Structure, and CO2 Reduction Reactivity of a Scandium(II) Complex, {Sc[N(SiMe3 )2 ]3 }<sup/>. Angewandte Chemie (International ed. in English) 56 (8) (2017)
Mikko Muuronen, Shane M Parker, Enrico Berardo, Alexander Le, Martijn A Zwijnenburg, Filipp Furche
Mechanism of photocatalytic water oxidation on small TiO2 nanoparticles. Chemical science 8 (3) (2016)