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Journal of Chemical Theory and Computation
|
March 10, 2016
Automated Selection of Active Orbital Spaces
Christopher J Stein, Markus Reiher
Journal of Chemical Theory and Computation
|
September 5, 2018
Error-Controlled Exploration of Chemical Reaction Networks with Gaussian Processes
Gregor N Simm, Markus Reiher
Physical Chemistry Chemical Physics : PCCP
|
January 14, 2011
New electron correlation theories for transition metal chemistry
Konrad H Marti, Markus Reiher
Journal of Chemical Theory and Computation
|
February 17, 2017
Steering Orbital Optimization out of Local Minima and Saddle Points Toward Lower Energy
Alain C Vaucher, Markus Reiher
Chimia
|
July 2, 2014
Determining factors for the accuracy of DMRG in chemistry
Sebastian F Keller, Markus Reiher
Chimia
|
April 27, 2021
On the Predictive Power of Chemical Concepts
Stephanie A Grimmel, Markus Reiher
Inorganic Chemistry
|
June 10, 2010
A unifying structural and electronic concept for Hmd and [FeFe] hydrogenase active sites
Martin T Stiebritz, Markus Reiher
Inorganic Chemistry
|
July 8, 2009
Theoretical study of dioxygen induced inhibition of [FeFe]-hydrogenase
Martin T Stiebritz, Markus Reiher
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
February 4, 2003
A quantum-chemical study of dinitrogen reduction at mononuclear iron-sulfur complexes with hints to the mechanism of nitrogenase
Markus Reiher, Bernd Artur Hess
Angewandte Chemie (International Ed. in English)
|
September 20, 2006
Intrinsic dinitrogen activation at bare metal atoms
Hans-Jörg Himmel, Markus Reiher
Page
of 27
Search research articles
Search
Showing results (61-70 of 270) with videos related to
Sort By:
Page
of 27
Journal of Chemical Theory and Computation
|
March 10, 2016
Automated Selection of Active Orbital Spaces
Christopher J Stein, Markus Reiher
Journal of Chemical Theory and Computation
|
September 5, 2018
Error-Controlled Exploration of Chemical Reaction Networks with Gaussian Processes
Gregor N Simm, Markus Reiher
Physical Chemistry Chemical Physics : PCCP
|
January 14, 2011
New electron correlation theories for transition metal chemistry
Konrad H Marti, Markus Reiher
Journal of Chemical Theory and Computation
|
February 17, 2017
Steering Orbital Optimization out of Local Minima and Saddle Points Toward Lower Energy
Alain C Vaucher, Markus Reiher
Chimia
|
July 2, 2014
Determining factors for the accuracy of DMRG in chemistry
Sebastian F Keller, Markus Reiher
Chimia
|
April 27, 2021
On the Predictive Power of Chemical Concepts
Stephanie A Grimmel, Markus Reiher
Inorganic Chemistry
|
June 10, 2010
A unifying structural and electronic concept for Hmd and [FeFe] hydrogenase active sites
Martin T Stiebritz, Markus Reiher
Inorganic Chemistry
|
July 8, 2009
Theoretical study of dioxygen induced inhibition of [FeFe]-hydrogenase
Martin T Stiebritz, Markus Reiher
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
February 4, 2003
A quantum-chemical study of dinitrogen reduction at mononuclear iron-sulfur complexes with hints to the mechanism of nitrogenase
Markus Reiher, Bernd Artur Hess
Angewandte Chemie (International Ed. in English)
|
September 20, 2006
Intrinsic dinitrogen activation at bare metal atoms
Hans-Jörg Himmel, Markus Reiher
Page
of 27