Yuliya Paukku : rechercher sur Z-Library

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1

Global triplet potential energy surfaces for the N 2 ( X 1 Σ) + O( 3P ) → NO( X 2 Π) + N( 4S ) reaction

Lin, Wei, Varga, Zoltan, Song, Guoliang, Paukku, Yuliya, Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2016

Langue:

english

Fichier:

PDF, 7.33 MB

english, 2016

2

Investigation on the low energy conformational surface of tabun to probe the role of its different conformers on biological activity

Yuliya Paukku, Andrea Michalkova, D. Majumdar, Jerzy Leszczynski

Journal:

Chemical Physics Letters

Année:

2006

Langue:

english

Fichier:

PDF, 348 KB

english, 2006

3

Structure-hepatoprotective activity relationship study of sesquiterpene lactones: A QSAR analysis

Yuliya Paukku, Bakhtiyor Rasulev, Vladimir Syrov, Zainab Khushbaktova, Jerzy Leszczynski

Journal:

International Journal of Quantum Chemistry

Année:

2009

Langue:

english

Fichier:

PDF, 256 KB

english, 2009

4

The Structure of Silica Surfaces Exposed to Atomic Oxygen

Norman, Paul, Schwartzentruber, Thomas E., Leverentz, Hannah, Luo, Sijie, Meana-Pañeda, Rubén, Paukku, Yuliya, Truhlar, Donald G.

Journal:

The Journal of Physical Chemistry C

Année:

2013

Langue:

english

Fichier:

PDF, 3.14 MB

english, 2013

5

Global ab initio ground-state potential energy surface of N4

Paukku, Yuliya, Yang, Ke R., Varga, Zoltan, Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2013

Langue:

english

Fichier:

PDF, 1.23 MB

english, 2013

6

Erratum: “Global ab initio ground-state potential energy surface of N4” [J. Chem. Phys. 139, 044309 (2013)]

Paukku, Yuliya, Yang, Ke R., Varga, Zoltan, Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2014

Langue:

english

Fichier:

PDF, 271 KB

english, 2014

7

Atomic Oxygen Recombination at Surface Defects on Reconstructed (0001) α-Quartz Exposed to Atomic and Molecular Oxygen

Meana-Pañeda, Rubén, Paukku, Yuliya, Duanmu, Kaining, Norman, Paul, Schwartzentruber, Thomas E., Truhlar, Donald G.

Journal:

The Journal of Physical Chemistry C

Année:

2015

Langue:

english

Fichier:

PDF, 6.85 MB

english, 2015

8

Potential energy surface of triplet N 2 O 2

Varga, Zoltan, Meana-Pañeda, Rubén, Song, Guoliang, Paukku, Yuliya, Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2016

Langue:

english

Fichier:

PDF, 4.81 MB

english, 2016

9

Potential energy surfaces of quintet and singlet O 4

Paukku, Yuliya, Yang, Ke R., Varga, Zoltan, Song, Guoliang, Bender, Jason D., Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2017

Langue:

english

Fichier:

PDF, 11.90 MB

english, 2017

10

Potential energy surfaces for O + O 2 collisions

Varga, Zoltan, Paukku, Yuliya, Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2017

Langue:

english

Fichier:

PDF, 1.35 MB

english, 2017

11

Potential energy surface of triplet O 4

Paukku, Yuliya, Varga, Zoltan, Truhlar, Donald G.

Journal:

The Journal of Chemical Physics

Année:

2018

Langue:

english

Fichier:

PDF, 3.37 MB

english, 2018