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Physical Chemistry Chemical Physics : PCCP
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April 25, 2006
Structure and dynamics of the [Zn(NH3)(H2O)5]2+ complex in aqueous solution obtained by an ab initio QM/MM molecular dynamics study
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Journal of Computational Chemistry
|
March 8, 2007
Quantum mechanical charge field molecular dynamics simulation of the TiO2+ ion in aqueous solution
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 1, 2009
The influence of heteroligands on the reactivity of Ni2+ in solution
Christian F Schwenk, Thomas S Hofer, Bernhard R Randolf, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 7, 2012
Guanidinium in aqueous solution studied by quantum mechanical charge field-molecular dynamics (QMCF-MD)
Alexander K H Weiss, Thomas S Hofer, Bernhard R Randolf, et al.
Chemical Physics Letters
|
April 9, 2013
Computational study of the cerium(III) ion in aqueous environment
Oliver M D Lutz, Thomas S Hofer, Bernhard R Randolf, et al.
Chemical Physics Letters
|
February 3, 2012
Hydration of highly charged ions
Thomas S Hofer, Alexander K H Weiss, Bernhard R Randolf, et al.
Chemical Physics Letters
|
April 9, 2013
Hydration of trivalent lanthanum revisited - An <i>ab initio</i> QMCF-MD approach
Oliver M D Lutz, Thomas S Hofer, Bernhard R Randolf, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 17, 2010
Hydrolytic conversion of AsO(-3)4 to HAsO(-2)4: a QMCF MD study
Anirban Bhattacharjee, Thomas S Hofer, Andreas B Pribil, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 19, 2010
Structure and dynamics of the UO2+ ion in aqueous solution: an ab initio QMCF-MD study
Robert J Frick, Thomas S Hofer, Andreas B Pribil, et al.
The Journal of Physical Chemistry. A
|
July 18, 2009
Structure and dynamics of the UO(2)(2+) ion in aqueous solution: an ab initio QMCF MD study
Robert J Frick, Thomas S Hofer, Andreas B Pribil, et al.
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Search research articles
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Showing results (21-30 of 43) with videos related to
Sort By:
Page
of 5
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2006
Structure and dynamics of the [Zn(NH3)(H2O)5]2+ complex in aqueous solution obtained by an ab initio QM/MM molecular dynamics study
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Journal of Computational Chemistry
|
March 8, 2007
Quantum mechanical charge field molecular dynamics simulation of the TiO2+ ion in aqueous solution
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 1, 2009
The influence of heteroligands on the reactivity of Ni2+ in solution
Christian F Schwenk, Thomas S Hofer, Bernhard R Randolf, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 7, 2012
Guanidinium in aqueous solution studied by quantum mechanical charge field-molecular dynamics (QMCF-MD)
Alexander K H Weiss, Thomas S Hofer, Bernhard R Randolf, et al.
Chemical Physics Letters
|
April 9, 2013
Computational study of the cerium(III) ion in aqueous environment
Oliver M D Lutz, Thomas S Hofer, Bernhard R Randolf, et al.
Chemical Physics Letters
|
February 3, 2012
Hydration of highly charged ions
Thomas S Hofer, Alexander K H Weiss, Bernhard R Randolf, et al.
Chemical Physics Letters
|
April 9, 2013
Hydration of trivalent lanthanum revisited - An <i>ab initio</i> QMCF-MD approach
Oliver M D Lutz, Thomas S Hofer, Bernhard R Randolf, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 17, 2010
Hydrolytic conversion of AsO(-3)4 to HAsO(-2)4: a QMCF MD study
Anirban Bhattacharjee, Thomas S Hofer, Andreas B Pribil, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 19, 2010
Structure and dynamics of the UO2+ ion in aqueous solution: an ab initio QMCF-MD study
Robert J Frick, Thomas S Hofer, Andreas B Pribil, et al.
The Journal of Physical Chemistry. A
|
July 18, 2009
Structure and dynamics of the UO(2)(2+) ion in aqueous solution: an ab initio QMCF MD study
Robert J Frick, Thomas S Hofer, Andreas B Pribil, et al.
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of 5