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The Journal of Physical Chemistry. B
|
July 30, 2015
Assessing Molecular Dynamics Simulations with Solvatochromism Modeling
Tobias Schwabe
Journal of Computational Chemistry
|
June 15, 2012
Accurate and fast treatment of large molecular systems: Assessment of CEPA and pCCSD within the local pair natural orbital approximation
Tobias Schwabe
Physical Chemistry Chemical Physics : PCCP
|
April 5, 2014
An isomeric reaction benchmark set to test if the performance of state-of-the-art density functionals can be regarded as independent of the external potential
Tobias Schwabe
The Journal of Physical Chemistry. A
|
March 12, 2013
Systematic study of the basis set superposition error in core-electron correlation effects
Tobias Schwabe
The Journal of Chemical Physics
|
October 27, 2016
General theory for environmental effects on (vertical) electronic excitation energies
Tobias Schwabe
Physical Chemistry Chemical Physics : PCCP
|
September 27, 2006
Towards chemical accuracy for the thermodynamics of large molecules: new hybrid density functionals including non-local correlation effects
Tobias Schwabe, Stefan Grimme
The Journal of Physical Chemistry. A
|
March 27, 2009
Benzenium-ethene complex: a fundamental problem for standard second-order Møller-Plesset theory
Tobias Schwabe, Stefan Grimme
Journal of Chemical Theory and Computation
|
December 16, 2017
Corrected Polarizable Embedding: Improving the Induction Contribution to Perichromism for Linear Response Theory
Heiner Schröder, Tobias Schwabe
Journal of Computational Chemistry
|
June 19, 2016
Efficient determination of accurate atomic polarizabilities for polarizeable embedding calculations
Heiner Schröder, Tobias Schwabe
Journal of Chemical Theory and Computation
|
August 2, 2017
Time-Dependent Double-Hybrid Density Functionals with Spin-Component and Spin-Opposite Scaling
Tobias Schwabe, Lars Goerigk
Page
of 3
Search research articles
Search
Showing results (1-10 of 29) with videos related to
Sort By:
Page
of 3
The Journal of Physical Chemistry. B
|
July 30, 2015
Assessing Molecular Dynamics Simulations with Solvatochromism Modeling
Tobias Schwabe
Journal of Computational Chemistry
|
June 15, 2012
Accurate and fast treatment of large molecular systems: Assessment of CEPA and pCCSD within the local pair natural orbital approximation
Tobias Schwabe
Physical Chemistry Chemical Physics : PCCP
|
April 5, 2014
An isomeric reaction benchmark set to test if the performance of state-of-the-art density functionals can be regarded as independent of the external potential
Tobias Schwabe
The Journal of Physical Chemistry. A
|
March 12, 2013
Systematic study of the basis set superposition error in core-electron correlation effects
Tobias Schwabe
The Journal of Chemical Physics
|
October 27, 2016
General theory for environmental effects on (vertical) electronic excitation energies
Tobias Schwabe
Physical Chemistry Chemical Physics : PCCP
|
September 27, 2006
Towards chemical accuracy for the thermodynamics of large molecules: new hybrid density functionals including non-local correlation effects
Tobias Schwabe, Stefan Grimme
The Journal of Physical Chemistry. A
|
March 27, 2009
Benzenium-ethene complex: a fundamental problem for standard second-order Møller-Plesset theory
Tobias Schwabe, Stefan Grimme
Journal of Chemical Theory and Computation
|
December 16, 2017
Corrected Polarizable Embedding: Improving the Induction Contribution to Perichromism for Linear Response Theory
Heiner Schröder, Tobias Schwabe
Journal of Computational Chemistry
|
June 19, 2016
Efficient determination of accurate atomic polarizabilities for polarizeable embedding calculations
Heiner Schröder, Tobias Schwabe
Journal of Chemical Theory and Computation
|
August 2, 2017
Time-Dependent Double-Hybrid Density Functionals with Spin-Component and Spin-Opposite Scaling
Tobias Schwabe, Lars Goerigk
Page
of 3