Density functional theory
Listing items with Subject "Density functional theory"
8 items found
Showing titles from 0 to 8:
| Format | Date | Title | Author |
|---|
| Format | Date | Title | Author |
|---|
|
2017 November 17 |
Computational study of nuclear magnetic shielding constants |
Castro Aguilera, Abril Carolina
|
|
2024 July 15 |
Exploring the reactivity of in situ generated metal vinylcarbenes |
DĂaz JimĂ©nez, Ă€lex
|
|
|
2017 February 24 |
New carbocyclisations of polyunsaturated hydrazones catalysed by rhodium(I) |
Torres AntĂłn, Ă’scar
|
|
|
|
New carbocyclisations of polyunsaturated hydrazones catalysed by rhodium(I) |
Torres AntĂłn, Ă’scar
|
|
|
|
Reactivity of fullerenes, endohedral metallofullerenes, and nanotubes, and their possible application in solar energy conversion |
MartĂnez LĂłpez, Juan Pablo
|
|
|
2016 November 18 |
Reactivity of fullerenes, endohedral metallofullerenes, and nanotubes, and their possible application in solar energy conversion |
MartĂnez LĂłpez, Juan Pablo
|
|
|
2016 July 20 |
Theoretical study of water oxidation and reduction mechanisms by aminopyridine first row transition metal catalysts |
Acuña-Parés, Ferran
|
|
|
|
Theoretical study of water oxidation and reduction mechanisms by aminopyridine first row transition metal catalysts |
Acuña-Parés, Ferran
|
