Filipp Furche

Affiliations

Department of Chemistry , University of California Irvine , Irvine , California 92697 , United States.

ORCID: http://orcid.org/0000-0001-8520-3971

Publications (40)

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

Avec: Adeayo O Ajala , Vamsee Voora , Narbe Mardirossian , Filipp Furche , Francesco Paesani

Room-Temperature Stable Ln(II) Complexes Supported by 2,6-Diadamantyl Aryloxide Ligands.

Inorganic chemistry

Avec: Lauren M Anderson-Sanchez , Jason M Yu , Joseph W Ziller , Filipp Furche , William J Evans

Gauge-Invariant Excited-State Linear and Quadratic Response Properties within the Meta-Generalized Gradient Approximation.

Journal of chemical theory and computation

Avec: Robin Grotjahn , Filipp Furche

Expanding the Scope of RNA Metabolic Labeling with Vinyl Nucleosides and Inverse Electron-Demand Diels-Alder Chemistry.

ACS chemical biology

Avec: Miles Kubota , Sarah Nainar , Shane M Parker , Whitney England , Filipp Furche , Robert C Spitale

Isolation of a Square-Planar Th(III) Complex: Synthesis and Structure of [Th(OC

Journal of the American Chemical Society

Avec: Daniel N Huh , Saswata Roy , Joseph W Ziller , Filipp Furche , William J Evans

Synthesis of Ln

Angewandte Chemie (International ed. in English)

Avec: Daniel N Huh , Sierra R Ciccone , Samuel Bekoe , Saswata Roy , Joseph W Ziller , Filipp Furche , William J Evans

Divergence of Many-Body Perturbation Theory for Noncovalent Interactions of Large Molecules.

Journal of chemical theory and computation

Avec: Brian D Nguyen , Guo P Chen , Matthew M Agee , Asbjörn M Burow , Matthew P Tang , Filipp Furche

Solid-State End-On to Side-On Isomerization of (N═N)

Journal of the American Chemical Society

Avec: Amanda B Chung , Dmitrij Rappoport , Joseph W Ziller , Roger E Cramer , Filipp Furche , William J Evans

Libkrylov: A modular open-source software library for extremely large on-the-fly matrix computations.

Journal of computational chemistry

Avec: Dmitrij Rappoport , Samuel Bekoe , Luke Nambi Mohanam , Scott Le , Naje' George , Ziyue Shen , Filipp Furche

Constructing the Mechanism of Dinoflagellate Luciferin Bioluminescence Using Computation.

The journal of physical chemistry letters

Avec: Gabriel S Phun , Dmitrij Rappoport , Filipp Furche , Tammie R Gibson , Sergei Tretiak

Investigating Steric and Electronic Effects in the Synthesis of Square Planar 6d

Inorganic chemistry

Avec: Joseph Q Nguyen , Justin C Wedal , Joseph W Ziller , Filipp Furche , William J Evans

A DFT perspective on organometallic lanthanide chemistry.

Dalton transactions (Cambridge, England : 2003)

Avec: Ahmadreza Rajabi , Robin Grotjahn , Dmitrij Rappoport , Filipp Furche

Multistate hybrid time-dependent density functional theory with surface hopping accurately captures ultrafast thymine photodeactivation.

Physical chemistry chemical physics : PCCP

Avec: Shane M Parker , Saswata Roy , Filipp Furche

5-Methoxyquinoline Photobasicity Is Mediated by Water Oxidation.

The journal of physical chemistry. A

Avec: Saswata Roy , Shane Ardo , Filipp Furche

TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations.

The Journal of chemical physics

Avec: Sree Ganesh Balasubramani , Guo P Chen , Sonia Coriani , Michael Diedenhofen , Marius S Frank , Yannick J Franzke , Filipp Furche , Robin Grotjahn , Michael E Harding , Christof Hättig , Arnim Hellweg , Benjamin Helmich-Paris , Christof Holzer , Uwe Huniar , Martin Kaupp , Alireza Marefat Khah , Sarah Karbalaei Khani , Thomas Müller , Fabian Mack , Brian D Nguyen , Shane M Parker , Eva Perlt , Dmitrij Rappoport , Kevin Reiter , Saswata Roy , Matthias Rückert , Gunnar Schmitz , Marek Sierka , Enrico Tapavicza , David P Tew , Christoph van Wüllen , Vamsee K Voora , Florian Weigend , Artur Wodyński , Jason M Yu

Selfconsistent random phase approximation methods.

The Journal of chemical physics

Avec: Jason M Yu , Brian D Nguyen , Jeffrey Tsai , Devin J Hernandez , Filipp Furche

Synthesis and Reduction of Heteroleptic Bis(cyclopentadienyl) Uranium(III) Complexes.

Inorganic chemistry

Avec: Justin C Wedal , Joseph W Ziller , Filipp Furche , William J Evans

Importance of imposing gauge invariance in time-dependent density functional theory calculations with meta-generalized gradient approximations.

The Journal of chemical physics

Avec: Robin Grotjahn , Filipp Furche , Martin Kaupp

TURBOMOLE: Today and Tomorrow.

Journal of chemical theory and computation

Avec: 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 Voora , Artur Wodyński , Jason M Yu , Benedikt Zerulla , Filipp Furche , Christof Hättig , Marek Sierka , David P Tew , Florian Weigend

Comment on: "Toward Accurate Two-Photon Absorption Spectrum Simulations: Exploring the Landscape beyond the Generalized Gradient Approximation".

The journal of physical chemistry letters

Avec: Robin Grotjahn , Filipp Furche

The Scandium(II) Carbonyl Complex (C

Journal of the American Chemical Society

Avec: Joshua D Queen , Quinn E Goudzwaard , Ahmadreza Rajabi , Joseph W Ziller , Filipp Furche , William J Evans

Formation of the End-on Bound Lanthanide Dinitrogen Complexes [(R

Journal of the American Chemical Society

Avec: Austin J Ryan , Sree Ganesh Balasubramani , Joseph W Ziller , Filipp Furche , William J Evans

Development and Implementation of Excited-State Gradients for Local Hybrid Functionals.

Journal of chemical theory and computation

Avec: Robin Grotjahn , Filipp Furche , Martin Kaupp

Theoretical Study of Divalent Bis(Pentaisopropylcyclopentadienyl) Actinocenes.

Inorganic chemistry

Avec: Jason M Yu , Filipp Furche

Density Functional Theory Analysis of the Importance of Coordination Geometry for 5f

Inorganic chemistry

Avec: Justin C Wedal , Filipp Furche , William J Evans

Strong Ferromagnetic Exchange Coupling and Single-Molecule Magnetism in MoS

Journal of the American Chemical Society

Avec: 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

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

Avec: Jared P Bruce , Kimberly Zhang , Sree Ganesh Balasubramani , Amanda R Haines , Randima P Galhenage , Vamsee K Voora , Filipp Furche , John C Hemminger

Static polarizabilities within the generalized Kohn-Sham semicanonical projected random phase approximation (GKS-spRPA).

The Journal of chemical physics

Avec: Sree Ganesh Balasubramani , Vamsee K Voora , Filipp Furche

Chemically Accurate Singlet-Triplet Gaps of Arylcarbenes from Local Hybrid Density Functionals.

The journal of physical chemistry. A

Avec: Robin Grotjahn , Justin Purnomo , Dayun Jin , Nicolas Lutfi , Filipp Furche

Dinitrogen reduction chemistry with scandium provides a complex with two side-on (N[double bond, length as m-dash]N)

Chemical science

Avec: Joshua D Queen , Ahmadreza Rajabi , Quinn E Goudzwaard , Qiong Yuan , Dang Khoa Nguyen , Joseph W Ziller , Filipp Furche , Zhenfeng Xi , William J Evans

Synthesis and Magnetism of Neutral, Linear Metallocene Complexes of Terbium(II) and Dysprosium(II).

Journal of the American Chemical Society

Avec: Colin A Gould , K Randall McClain , Jason M Yu , Thomas J Groshens , Filipp Furche , Benjamin G Harvey , Jeffrey R Long

In search of tris(trimethylsilylcyclopentadienyl) thorium.

Dalton transactions (Cambridge, England : 2003)

Avec: Justin C Wedal , Samuel Bekoe , Joseph W Ziller , Filipp Furche , William J Evans

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

Avec: Vamsee K Voora , Randima Galhenage , John C Hemminger , Filipp Furche

2.2.2-Cryptand complexes of neptunium(III) and plutonium(III).

Chemical communications (Cambridge, England)

Avec: 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

High-Resolution X-ray Photoelectron Spectroscopy of Organometallic (C

Journal of the American Chemical Society

Avec: Daniel N Huh , Jared P Bruce , Sree Ganesh Balasubramani , Sierra R Ciccone , Filipp Furche , John C Hemminger , William J Evans

A 9.2-GHz clock transition in a Lu(II) molecular spin qubit arising from a 3,467-MHz hyperfine interaction.

Nature chemistry

Avec: Krishnendu Kundu , Jessica R K White , Samuel A Moehring , Jason M Yu , Joseph W Ziller , Filipp Furche , William J Evans , Stephen Hill

Reduction of Rare-Earth Metal Complexes Induced by γ Irradiation.

Inorganic chemistry

Avec: William N G Moore , Jessica R K White , Justin C Wedal , 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)

Avec: Kito Gilbert-Bass , Cary R Stennett , Robin Grotjahn , Joseph W Ziller , Filipp Furche , William J Evans

Natural determinant reference functional theory.

The Journal of chemical physics

Avec: Jason M Yu , Jeffrey Tsai , Ahmadreza Rajabi , Dmitrij Rappoport , Filipp Furche

Synthesis of Crystallographically Characterizable Bis(cyclopentadienyl) Sc(II) Complexes: (C

Journal of the American Chemical Society

Avec: Joshua D Queen , Lauren M Anderson-Sanchez , Cary R Stennett , Ahmadreza Rajabi , Joseph W Ziller , Filipp Furche , William J Evans

Réseau de co-auteurs

William J Evans 18 collaborations

Joseph W Ziller 15 collaborations

Robin Grotjahn 9 collaborations

Jason M Yu 8 collaborations

Dmitrij Rappoport 7 collaborations

Ahmadreza Rajabi 6 collaborations

Saswata Roy 5 collaborations

Brian D Nguyen 5 collaborations

Justin C Wedal 5 collaborations

Sree Ganesh Balasubramani 5 collaborations

Shane M Parker 4 collaborations

Samuel Bekoe 4 collaborations

Martin Kaupp 4 collaborations

Vamsee K Voora 4 collaborations

Daniel N Huh 3 collaborations

Sierra R Ciccone 3 collaborations

Eva Perlt 3 collaborations

Joshua D Queen 3 collaborations

John C Hemminger 3 collaborations

Vamsee Voora 2 collaborations

Lauren M Anderson-Sanchez 2 collaborations

Guo P Chen 2 collaborations

Gabriel S Phun 2 collaborations

Sonia Coriani 2 collaborations

Yannick J Franzke 2 collaborations

Christof Hättig 2 collaborations

Christof Holzer 2 collaborations

Fabian Mack 2 collaborations

Marek Sierka 2 collaborations

Enrico Tapavicza 2 collaborations

David P Tew 2 collaborations

Florian Weigend 2 collaborations

Artur Wodyński 2 collaborations

Jeffrey Tsai 2 collaborations

Sourav Majumdar 2 collaborations

Quinn E Goudzwaard 2 collaborations

Jeffrey R Long 2 collaborations

Jared P Bruce 2 collaborations

Jessica R K White 2 collaborations

Cary R Stennett 2 collaborations

Adeayo O Ajala 1 collaboration

Narbe Mardirossian 1 collaboration

Francesco Paesani 1 collaboration

Miles Kubota 1 collaboration

Sarah Nainar 1 collaboration

Whitney England 1 collaboration

Robert C Spitale 1 collaboration

Matthew M Agee 1 collaboration

Asbjörn M Burow 1 collaboration

Matthew P Tang 1 collaboration

Amanda B Chung 1 collaboration

Roger E Cramer 1 collaboration

Luke Nambi Mohanam 1 collaboration

Scott Le 1 collaboration

Naje' George 1 collaboration

Ziyue Shen 1 collaboration

Tammie R Gibson 1 collaboration

Sergei Tretiak 1 collaboration

Joseph Q Nguyen 1 collaboration

Shane Ardo 1 collaboration

Michael Diedenhofen 1 collaboration

Marius S Frank 1 collaboration

Michael E Harding 1 collaboration

Arnim Hellweg 1 collaboration

Benjamin Helmich-Paris 1 collaboration

Uwe Huniar 1 collaboration

Alireza Marefat Khah 1 collaboration

Sarah Karbalaei Khani 1 collaboration

Thomas Müller 1 collaboration

Kevin Reiter 1 collaboration

Matthias Rückert 1 collaboration

Gunnar Schmitz 1 collaboration

Christoph van Wüllen 1 collaboration

Devin J Hernandez 1 collaboration

Josefine H Andersen 1 collaboration

Tomislav Begušić 1 collaboration

Florian Bruder 1 collaboration

Fabio Della Sala 1 collaboration

Eduardo Fabiano 1 collaboration

Daniil A Fedotov 1 collaboration

Susanne Fürst 1 collaboration

Sebastian Gillhuber 1 collaboration

Max Kehry 1 collaboration

Marjan Krstić 1 collaboration

Fabian Pauly 1 collaboration

Ansgar Pausch 1 collaboration

Bibek Samal 1 collaboration

Tim Schrader 1 collaboration

Manas Sharma 1 collaboration

Robert S Treß 1 collaboration

Benedikt Zerulla 1 collaboration

Austin J Ryan 1 collaboration

Lucy E Darago 1 collaboration

Monica D Boshart 1 collaboration

Wayne W Lukens 1 collaboration

Kimberly Zhang 1 collaboration

Amanda R Haines 1 collaboration

Randima P Galhenage 1 collaboration

Justin Purnomo 1 collaboration

Dayun Jin 1 collaboration

Nicolas Lutfi 1 collaboration

Qiong Yuan 1 collaboration

Dang Khoa Nguyen 1 collaboration

Zhenfeng Xi 1 collaboration

Colin A Gould 1 collaboration

K Randall McClain 1 collaboration

Thomas J Groshens 1 collaboration

Benjamin G Harvey 1 collaboration

Randima Galhenage 1 collaboration

Conrad A P Goodwin 1 collaboration

Brian L Scott 1 collaboration

Andrew J Gaunt 1 collaboration

Krishnendu Kundu 1 collaboration

Samuel A Moehring 1 collaboration

Stephen Hill 1 collaboration

William N G Moore 1 collaboration

Kito Gilbert-Bass 1 collaboration