Relativistic nuclear magnetic resonance chemical shifts of heavy nuclei with pseudopotentials and the zeroth-order regular approximation
Egile Nagusiak: | Yates, JR, Pickard, C, Payne, M, Mauri, F |
---|---|
Formatua: | Journal article |
Argitaratua: |
2003
|
Antzeko izenburuak
-
Relativistic nuclear magnetic resonance J-coupling with ultrasoft pseudopotentials and the zeroth-order regular approximation.
nork: Green, T, et al.
Argitaratua: (2014) -
Calculation of NMR chemical shifts for extended systems using ultrasoft pseudopotentials
nork: Yates, JR, et al.
Argitaratua: (2007) -
Pseudopotentials in the theory of metals /
nork: Harrison, Walter A. (Walter Ashley), 1930-
Argitaratua: (1966) -
Prediction of NMR J-coupling in solids with the planewave pseudopotential approach.
nork: Yates, JR
Argitaratua: (2010) -
Adaptive evolution strategies for stochastic zeroth-order optimization
nork: He, Xiaoyu, et al.
Argitaratua: (2022)