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The Journal of Chemical Physics
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March 25, 2014
Frozen density embedding with non-integer subsystems' particle numbers
Eduardo Fabiano, Savio Laricchia, Fabio Della Sala
Journal of Chemical Theory and Computation
|
November 19, 2015
Laplacian-Level Kinetic Energy Approximations Based on the Fourth-Order Gradient Expansion: Global Assessment and Application to the Subsystem Formulation of Density Functional Theory
Savio Laricchia, Lucian A Constantin, Eduardo Fabiano, et al.
The Journal of Chemical Physics
|
April 24, 2015
Subsystem density functional theory with meta-generalized gradient approximation exchange-correlation functionals
Szymon Śmiga, Eduardo Fabiano, Savio Laricchia, et al.
The Journal of Chemical Physics
|
January 10, 2012
Structure, electronic, and optical properties of TiO2 atomic clusters: an ab initio study
Letizia Chiodo, Martin Salazar, Aldo H Romero, et al.
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Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
March 25, 2014
Frozen density embedding with non-integer subsystems' particle numbers
Eduardo Fabiano, Savio Laricchia, Fabio Della Sala
Journal of Chemical Theory and Computation
|
November 19, 2015
Laplacian-Level Kinetic Energy Approximations Based on the Fourth-Order Gradient Expansion: Global Assessment and Application to the Subsystem Formulation of Density Functional Theory
Savio Laricchia, Lucian A Constantin, Eduardo Fabiano, et al.
The Journal of Chemical Physics
|
April 24, 2015
Subsystem density functional theory with meta-generalized gradient approximation exchange-correlation functionals
Szymon Śmiga, Eduardo Fabiano, Savio Laricchia, et al.
The Journal of Chemical Physics
|
January 10, 2012
Structure, electronic, and optical properties of TiO2 atomic clusters: an ab initio study
Letizia Chiodo, Martin Salazar, Aldo H Romero, et al.
Page
of 1