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The Journal of Chemical Physics
|
June 3, 2009
New model core potentials for gold
Tao Zeng, Mariusz Klobukowski
The Journal of Physical Chemistry. A
|
May 22, 2008
Relativistic model core potential study of the Au+ Xe system
Tao Zeng, Mariusz Klobukowski
Journal of Computational Chemistry
|
April 30, 2004
Improved model core potentials for the second- and third-row transition metals
Christopher C Lovallo, Mariusz Klobukowski
The Journal of Chemical Physics
|
July 23, 2004
Accurate ab initio pair potentials between helium and the heavier group 2 elements
Christopher C Lovallo, Mariusz Klobukowski
Journal of Computational Chemistry
|
May 22, 2003
Development of new pseudopotential methods: improved model core potentials for the first-row transition metals
Christopher C Lovallo, Mariusz Klobukowski
The Journal of Chemical Physics
|
January 19, 2011
Performance of dynamically weighted multiconfiguration self-consistent field and spin-orbit coupling calculations of diatomic molecules of Group 14 elements
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
Journal of Molecular Graphics & Modelling
|
July 23, 2013
Similarity-based virtual screening for microtubule stabilizers reveals novel antimitotic scaffold
Ahmed T Ayoub, Mariusz Klobukowski, Jack Tuszynski
The Journal of Chemical Physics
|
October 2, 2009
Model core potentials for studies of scalar-relativistic effects and spin-orbit coupling at Douglas-Kroll level. I. Theory and applications to Pb and Bi
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
The Journal of Chemical Physics
|
September 28, 2010
Model core potentials of p-block elements generated considering the Douglas-Kroll relativistic effects, suitable for accurate spin-orbit coupling calculations
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
The Journal of Chemical Physics
|
February 23, 2010
Multireference study of spin-orbit coupling in the hydrides of the 6p-block elements using the model core potential method
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
Page
of 4
Search research articles
Search
Showing results (1-10 of 38) with videos related to
Sort By:
Page
of 4
The Journal of Chemical Physics
|
June 3, 2009
New model core potentials for gold
Tao Zeng, Mariusz Klobukowski
The Journal of Physical Chemistry. A
|
May 22, 2008
Relativistic model core potential study of the Au+ Xe system
Tao Zeng, Mariusz Klobukowski
Journal of Computational Chemistry
|
April 30, 2004
Improved model core potentials for the second- and third-row transition metals
Christopher C Lovallo, Mariusz Klobukowski
The Journal of Chemical Physics
|
July 23, 2004
Accurate ab initio pair potentials between helium and the heavier group 2 elements
Christopher C Lovallo, Mariusz Klobukowski
Journal of Computational Chemistry
|
May 22, 2003
Development of new pseudopotential methods: improved model core potentials for the first-row transition metals
Christopher C Lovallo, Mariusz Klobukowski
The Journal of Chemical Physics
|
January 19, 2011
Performance of dynamically weighted multiconfiguration self-consistent field and spin-orbit coupling calculations of diatomic molecules of Group 14 elements
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
Journal of Molecular Graphics & Modelling
|
July 23, 2013
Similarity-based virtual screening for microtubule stabilizers reveals novel antimitotic scaffold
Ahmed T Ayoub, Mariusz Klobukowski, Jack Tuszynski
The Journal of Chemical Physics
|
October 2, 2009
Model core potentials for studies of scalar-relativistic effects and spin-orbit coupling at Douglas-Kroll level. I. Theory and applications to Pb and Bi
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
The Journal of Chemical Physics
|
September 28, 2010
Model core potentials of p-block elements generated considering the Douglas-Kroll relativistic effects, suitable for accurate spin-orbit coupling calculations
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
The Journal of Chemical Physics
|
February 23, 2010
Multireference study of spin-orbit coupling in the hydrides of the 6p-block elements using the model core potential method
Tao Zeng, Dmitri G Fedorov, Mariusz Klobukowski
Page
of 4