scholarly journals Spin Density Distribution in Open-Shell Transition Metal Systems: A Comparative Post-Hartree–Fock, Density Functional Theory, and Quantum Monte Carlo Study of the CuCl2 Molecule

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pp. 5286-5296 ◽  
Author(s):  
Michel Caffarel ◽  
Emmanuel Giner ◽  
Anthony Scemama ◽  
Alejandro Ramírez-Solís
Keyword(s):  
Density Functional Theory ◽  
Monte Carlo ◽  
Transition Metal ◽  
Density Distribution ◽  
Quantum Monte Carlo ◽  
Density Functional ◽  
Monte Carlo Study ◽  
Open Shell ◽  
Functional Theory ◽  
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scholarly journals Microstructure of Flow-Driven Suspension of Hardspheres in Cylindrical Confinement: A Dynamical Density Functional Theory and Monte Carlo Study

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pp. 11332-11344 ◽  
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Zahera Jabeen ◽  
David M. Eckmann ◽  
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Keyword(s):  
Density Functional Theory ◽  
Monte Carlo ◽  
Density Functional ◽  
Monte Carlo Study ◽  
Functional Theory
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