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

Authors : Robin Grotjahn , Filipp Furche
Journal : Journal of Chemical Theory and Computation
Journal Reference count : 96
Volume : 19
Pages : 4897-4911
2023

Basis set convergence of molecular correlation energy differences within the random phase approximation

Authors : Henk Eshuis , Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 40
Volume : 136
2012

Property-optimized Gaussian basis sets for molecular response calculations

Authors : Dmitrij Rappoport , Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 80
Volume : 133
2010

First-order nonadiabatic couplings from time-dependent hybrid density functional response theory: Consistent formalism, implementation, and performance

Authors : Robert Send , Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 109
Volume : 132
2010

Is There Symmetry Breaking in the First Excited Singlet State of 2-Pyridone Dimer?

Authors : Espen Sagvolden , Filipp Furche
Journal : The Journal of Physical Chemistry A
Journal Reference count : 53
Volume : 114
Pages : 6897-6903
2010

Structure of endohedral fullerene Eu@C74

Authors : Dmitrij Rappoport , Filipp Furche
Journal : Physical Chemistry Chemical Physics
Journal Reference count : 39
Volume : 11
Pages : 6353
2009

Theoretische Chemie 2008

Authors : Dmitrij Rappoport , Filipp Furche
Journal : Nachrichten aus der Chemie
Journal Reference count : 76
Volume : 57
Pages : 305-311
2009

Developing the random phase approximation into a practical post-Kohn–Sham correlation model

Authors : Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 59
Volume : 129
2008

Lagrangian approach to molecular vibrational Raman intensities using time-dependent hybrid density functional theory

Authors : Dmitrij Rappoport , Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 39
Volume : 126
2007

Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large molecules

Authors : Dmitrij Rappoport , Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 48
Volume : 122
2005

Erratum: “Time-dependent density functional methods for excited state properties” [J. Chem. Phys. 117, 7433 (2002)]

Authors : Filipp Furche , Reinhart Ahlrichs
Journal : The Journal of Chemical Physics
Volume : 121
Pages : 12772-12773
2004

Photoinduced Intramolecular Charge Transfer in 4-(Dimethyl)aminobenzonitrile − A Theoretical Perspective

Authors : Dmitrij Rappoport , Filipp Furche
Journal : Journal of the American Chemical Society
Journal Reference count : 98
Volume : 126
Pages : 1277-1284
2004

Towards a practical pair density-functional theory for many-electron systems

Authors : Filipp Furche
Journal : Physical Review A
Journal Reference count : 36
Volume : 70
2004

Absolute Configuration of D2-Symmetric Fullerene C84

Authors : Filipp Furche , Reinhart Ahlrichs
Journal : Journal of the American Chemical Society
Journal Reference count : 26
Volume : 124
Pages : 3804-3805
2002

Efficient characterization of stationary points on potential energy surfaces

Authors : Peter Deglmann , Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 17
Volume : 117
Pages : 9535-9538
2002

ChemInform Abstract: Absolute Configuration of D2‐Symmetric Fullerene C84.

Authors : Filipp Furche , Reinhart Ahlrichs
Journal : ChemInform
Journal Reference count : 1
Volume : 33
2002

On the density matrix based approach to time-dependent density functional response theory

Authors : Filipp Furche
Journal : The Journal of Chemical Physics
Journal Reference count : 51
Volume : 114
Pages : 5982-5992
2001

Molecular tests of the random phase approximation to the exchange-correlation energy functional

Authors : Filipp Furche
Journal : Physical Review B
Journal Reference count : 64
Volume : 64
2001