Suleimanov, Yury V.: search on Z-Library

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1

Electronic to Vibrational Energy Transfer Assisted by Interacting Transition Dipole Moments: A Quantum Model for the Nonadiabatic I 2 ( E ) + CF 4 Collisions

Suleimanov, Yury V., Buchachenko, Alexei A.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 217 KB

english, 2007

2

Publisher’s Note: “Bimolecular reaction rates from ring polymer molecular dynamics” [J. Chem. Phys. 130, 174713 (2009)]

Collepardo-Guevara, Rosana, Suleimanov, Yury V., Manolopoulos, David E.

Journal:

The Journal of Chemical Physics

Year:

2009

File:

PDF, 32 KB

2009

3

Iastreb moǐ

Karageorge, Yuri Vidov, Suleǐmanov, Abdul-Vagab, Akchurin, M., Evpatov, Vladimir, Baǐbakov, Viacheslav

Journal:

World Literature Today

Year:

1985

Language:

english

File:

PDF, 385 KB

english, 1985

4

Bimolecular reaction rates from ring polymer molecular dynamics

Collepardo-Guevara, Rosana, Suleimanov, Yury V., Manolopoulos, David E.

Journal:

The Journal of Chemical Physics

Year:

2009

Language:

english

File:

PDF, 705 KB

english, 2009

5

Bimolecular reaction rates from ring polymer molecular dynamics: Application to H + CH4→ H2 + CH3

Suleimanov, Yury V., Collepardo-Guevara, Rosana, Manolopoulos, David E.

Journal:

The Journal of Chemical Physics

Year:

2011

Language:

english

File:

PDF, 671 KB

english, 2011

6

Automated Discovery of Elementary Chemical Reaction Steps Using Freezing String and Berny Optimization Methods

Suleimanov, Yury V., Green, William H.

Journal:

Journal of Chemical Theory and Computation

Year:

2015

Language:

english

File:

PDF, 3.42 MB

english, 2015

7

Quantum Roaming in the Complex Forming Mechanism of the Reactions of OH with formaldehyde and methanol at Low Temperature and Zero Pressure: A Ring Polymer Molecular Dynamics Approach

del Mazo-Sevillano, Pablo, Aguado, Alfredo, Jimenez, Elena, Suleimanov, Yury V., Roncero, Octavio

Journal:

The Journal of Physical Chemistry Letters

Year:

2019

File:

PDF, 1.51 MB

2019

8

Rate coefficients and kinetic isotope effects of the X + CH4 → CH3 + HX (X = H, D, Mu) reactions from ring polymer molecular dynamics

Li, Yongle, Suleimanov, Yury V., Li, Jun, Green, William H., Guo, Hua

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 1.17 MB

english, 2013

9

Inside Back Cover: Cross-Aldol Reaction of Isatin with Acetone Catalyzed by Leucinol: A Mechanistic Investigation (Chem. Eur. J. 34/2015)

Kabeshov, Mikhail A., Kysilka, Ondřej, Rulíšek, Lubomír, Suleimanov, Yury V., Bella, Marco, Malkov, Andrei V., Kočovský, Pavel

Journal:

Chemistry - A European Journal

Year:

2015

File:

PDF, 1.84 MB

2015

10

Surface Diffusion of Hydrogen on Ni(100) from Ring Polymer Molecular Dynamics

Suleimanov, Yury V.

Journal:

Journal of Physical Chemistry A

Year:

2012

Language:

english

File:

PDF, 5.30 MB

english, 2012

11

A Signature of Roaming Dynamics in the Thermal Decomposition of Ethyl Nitrite: Chirped-Pulse Rotational Spectroscopy and Kinetic Modeling

Prozument, Kirill, Suleimanov, Yury V., Buesser, Beat, Oldham, James M., Green, William H., Suits, Arthur G., Field, Robert W.

Journal:

The Journal of Physical Chemistry Letters

Year:

2014

Language:

english

File:

PDF, 1.01 MB

english, 2014

12

A ring polymer molecular dynamics study of the OH + H 2 (D 2 ) reaction

Castillo, Jesus F, Suleimanov, Yury

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 599 KB

english, 2017

13

Unimolecular Reaction Pathways of a γ-Ketohydroperoxide from Combined Application of Automated Reaction Discovery Methods

Grambow, Colin A., Jamal, Adeel, Li, Yi-Pei, Green, William H., Zádor, Judit, Suleimanov, Yury V.

Journal:

Journal of the American Chemical Society

Year:

2017

Language:

english

File:

PDF, 865 KB

english, 2017

14

Recrossing and Tunneling in the Kinetics Study of the OH + CH 4 → H 2 O + CH 3 Reaction

Suleimanov, Yury V., Espinosa-Garcia, J.

Journal:

Journal of Physical Chemistry B

Year:

2015

Language:

english

File:

PDF, 1.27 MB

english, 2015

15

Rate Coefficient for the 4 Heμ + CH 4 Reaction at 500 K: Comparison between Theory and Experiment

Arseneau, Donald J., Fleming, Donald G., Li, Yongle, Li, Jun, Suleimanov, Yury V., Guo, Hua

Journal:

Journal of Physical Chemistry B

Year:

2015

Language:

english

File:

PDF, 824 KB

english, 2015

16

New Stress Test for Ring Polymer Molecular Dynamics: Rate Coefficients of the O( 3P )+HCl Reaction and Comparison with Quantum Mechanical and Quasiclassical Trajectory Results

Menendez, Marta, Jambrina, Pablo G., Zanchet, Alexandre, Verdasco, Enrique, Suleimanov, Yury V., Aoiz, F. Javier

Journal:

Journal of Physical Chemistry A

Year:

2019

Language:

english

File:

PDF, 1.02 MB

english, 2019

17

Stress Test for Quantum Dynamics Approximations: Deep Tunneling in the Muonium Exchange Reaction D + HMu → DMu + H

Pérez de Tudela, Ricardo, Suleimanov, Yury V., Richardson, Jeremy O., Sáez Rábanos, Vicente, Green, William H., Aoiz, F. J.

Journal:

The Journal of Physical Chemistry Letters

Year:

2014

Language:

english

File:

PDF, 641 KB

english, 2014

18

Dynamics and mechanism of the E→D, D[sup ʹ], β, γ, and δ nonadiabatic transitions induced in molecular iodine by collisions with CF[sub 4] and SF[sub 6] molecules

Akopyan, Mikhail E., Lukashov, Sergey S., Poretsky, Sergey A., Pravilov, Anatoly M., Torgashkova, Anna S., Buchachenko, Alexei A., Suleimanov, Yury V.

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 699 KB

english, 2008

19

Ring Polymer Molecular Dynamics Calculations of Thermal Rate Constants for the O( 3 P) + CH 4 → OH + CH 3 Reaction: Contributions of Quantum Effects

Li, Yongle, Suleimanov, Yury V., Yang, Minghui, Green, William H., Guo, Hua

Journal:

The Journal of Physical Chemistry Letters

Year:

2013

Language:

english

File:

PDF, 581 KB

english, 2013

20

Chemical Reaction Rates from Ring Polymer Molecular Dynamics: Zero Point Energy Conservation in Mu + H 2 → MuH + H

Pérez de Tudela, Ricardo, Aoiz, F. J., Suleimanov, Yury V., Manolopoulos, David E.

Journal:

The Journal of Physical Chemistry Letters

Year:

2012

Language:

english

File:

PDF, 997 KB

english, 2012

21

Theoretical and experimental studies of collision-induced electronic energy transfer from v=0–3 of the E(0[sub g]+]) ion-pair state of Br[sub 2]: Collisions with He and Ar

Hutchison, J. Matthew, O’Hern, Robin R., Stephenson, Thomas A., Suleimanov, Yury V., Buchachenko, Alexei A.

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 828 KB

english, 2008

22

Communication: Full dimensional quantum rate coefficients and kinetic isotope effects from ring polymer molecular dynamics for a seven-atom reaction OH + CH4 → CH3 + H2O

Allen, Joshua W., Green, William H., Li, Yongle, Guo, Hua, Suleimanov, Yury V.

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 254 KB

english, 2013

23

A Combined Theoretical and Experimental Investigation of the Kinetics and Dynamics of the O(1D) + D2 Reaction at Low Temperature

Nunez-Reyes, Dianailys, Hickson, Kevin M., Larregaray, P., Bonnet, Claude-Laurent, González-Lezana, Tomás, Suleimanov, Yury V

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.61 MB

english, 2018

24

[IEEE 2019 IEEE International Conference on Advanced Trends in Information Theory (ATIT) - Kyiv, Ukraine (2019.12.18-2019.12.20)] 2019 IEEE International Conference on Advanced Trends in Information Theory (ATIT) - Processing Technique of Weighted Data to Improve Assessment of Latent Information.

Lefterov, Oleksandr, Naguliak, Oleg, Netreba, Iryna, Radchenko, Serhii, Sudakov, Oleksandr, Suleimanov, Yuri

Year:

2019

File:

PDF, 506 KB

2019

25

Zeeman relaxation of magnetically trapped Eu atoms

Suleimanov, Yury V.

Journal:

Physical Review A

Year:

2010

Language:

english

File:

PDF, 453 KB

english, 2010

26

Dynamics of H + HeH + ( v = 0, j = 0) → H 2+ + He: Insight on the Possible Complex-Forming Behavior of the Reaction

González-Lezana, Tomás, Bossion, Duncan, Scribano, Yohann, Bhowmick, Somnath, Suleimanov, Yury V.

Journal:

Journal of Physical Chemistry A

Year:

2019

File:

PDF, 1.28 MB

2019

27

Thermal Rate Coefficients for the Astrochemical Process C + CH + → C 2+ + H by Ring Polymer Molecular Dynamics

Rampino, Sergio, Suleimanov, Yury V.

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 1.03 MB

english, 2016

28

Low-Temperature Experimental and Theoretical Rate Constants for the O( 1 D) + H 2 Reaction

Hickson, Kevin M., Suleimanov, Yury V.

Journal:

Journal of Physical Chemistry A

Year:

2017

Language:

english

File:

PDF, 517 KB

english, 2017

29

Ring-Polymer Molecular Dynamics Rate Coefficient Calculations for Insertion Reactions: X + H 2 → HX + H (X = N, O)

Li, Yongle, Suleimanov, Yury V., Guo, Hua

Journal:

The Journal of Physical Chemistry Letters

Year:

2014

Language:

english

File:

PDF, 1.29 MB

english, 2014

30

ChemInform Abstract: Chemical Reaction Rate Coefficients from Ring Polymer Molecular Dynamics: Theory and Practical Applications

Suleimanov, Yury V., Aoiz, F. Javier, Guo, Hua

Journal:

Year:

2016

File:

PDF, 16 KB

2016

31

Kinetics Study of the CN + CH4 hydrogen abstraction reaction based on a new ab initio analytical full-dimensional potential energy surface

Espinosa-Garcia, J, Rangel, Cipriano, Suleimanov, Yury V.

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.24 MB

english, 2017

32

Erratum: “Bimolecular reaction rates from ring polymer molecular dynamics” [J. Chem. Phys. 130, 174713 (2009)]

Collepardo-Guevara, Rosana, Suleimanov, Yury V., Manolopoulos, David E.

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 380 KB

english, 2010

33

Inside Back Cover: Cross-Aldol Reaction of Isatin with Acetone Catalyzed by Leucinol: A Mechanistic Investigation (Chem. Eur. J. 34/2015)

Kabeshov, Mikhail A., Kysilka, Ondřej, Rulíšek, Lubomír, Suleimanov, Yury V., Bella, Marco, Malkov, Andrei V., Kočovský, Pavel

Journal:

Chemistry - A European Journal

Year:

2015

File:

PDF, 1.84 MB

2015

34

An experimental and theoretical investigation of the C( 1 D) + D 2 reaction

Hickson, Kevin M., Suleimanov, Yury V.

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.02 MB

english, 2017

35

Efficient numerical method for locating Feshbach resonances of ultracold molecules in external fields

Suleimanov, Yury V., Krems, Roman V.

Journal:

The Journal of Chemical Physics

Year:

2011

Language:

english

File:

PDF, 357 KB

english, 2011

36

Quantum Rate Coefficients and Kinetic Isotope Effect for the Reaction Cl + CH 4 → HCl + CH 3 from Ring Polymer Molecular Dynamics

Li, Yongle, Suleimanov, Yury V., Green, William H., Guo, Hua

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.56 MB

english, 2014

37

Chemical Reaction Rate Coefficients from Ring Polymer Molecular Dynamics: Theory and Practical Applications

Suleimanov, Yury V., Aoiz, F. Javier, Guo, Hua

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 3.12 MB

english, 2016

38

Low temperature rates for key steps of interstellar gas-phase water formation

Kumar, Sunil S., Grussie, Florian, Suleimanov, Yury V., Guo, Hua, Kreckel, Holger

Journal:

Science Advances

Year:

2018

Language:

english

File:

PDF, 528 KB

english, 2018

39

A ring polymer molecular dynamics study of the isotopologues of the H + H2 reaction

Suleimanov, Yury V., de Tudela, Ricardo Pérez, Jambrina, Pablo G., Castillo, Jesús F., Sáez-Rábanos, Vicente, Manolopoulos, David E., Aoiz, F. Javier

Journal:

Physical Chemistry Chemical Physics

Year:

2013

Language:

english

File:

PDF, 860 KB

english, 2013

40

Should thermostatted ring polymer molecular dynamics be used to calculate thermal reaction rates?

Hele, Timothy J. H., Suleimanov, Yury V.

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 930 KB

english, 2015

41

Cross-Aldol Reaction of Isatin with Acetone Catalyzed by Leucinol: A Mechanistic Investigation

Kabeshov, Mikhail A., Kysilka, Ondřej, Rulíšek, Lubomír, Suleimanov, Yury V., Bella, Marco, Malkov, Andrei V., Kočovský, Pavel

Journal:

Chemistry - A European Journal

Year:

2015

Language:

english

File:

PDF, 960 KB

english, 2015

42

Ring-polymer molecular dynamics: Rate coefficient calculations for energetically symmetric (near thermoneutral) insertion reactions (X + H 2 ) → HX + H(X = C( 1D ), S( 1D ))

Suleimanov, Yury V., Kong, Wendi J., Guo, Hua, Green, William H.

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 436 KB

english, 2014

43

A Ring Polymer Molecular Dynamics Approach to Study the Transition between Statistical and Direct Mechanisms in the H_2+H_3⁺ --> H_3⁺ +H_2 Reaction

Suleimanov, Yury V., Aguado, Alfredo, Gomez-Carrasco, Susana, Roncero, Octavio

Journal:

The Journal of Physical Chemistry Letters

Year:

2018

Language:

english

File:

PDF, 629 KB

english, 2018

44

Metallocyclopentadienyl derivatives of bivalent samarium, europium and ytterbium

Gul'mamed Z. Suleimanov, Yuri S. Bogatchev, Leila T. Abdullaeva, Irina L. Zhuravleva, Khalil S. Khalilov, Lyudmila F. Rybakova, Irina P. Beletskaya

Journal:

Year:

1985

Language:

english

File:

PDF, 266 KB

english, 1985

45

Theoretical Kinetics Study of the O( 3 P) + CH 4 /CD 4 Hydrogen Abstraction Reaction: The Role of Anharmonicity, Recrossing Effects, and Quantum Mechanical Tunneling

Gonzalez-Lavado, Eloisa, Corchado, Jose C., Suleimanov, Yury V., Green, William H., Espinosa-Garcia, Joaquin

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 741 KB

english, 2014

46

Ring-Polymer Molecular Dynamics for the Prediction of Low-Temperature Rates: An Investigation of the C( 1 D) + H 2 Reaction

Hickson, Kevin M., Loison, Jean-Christophe, Guo, Hua, Suleimanov, Yury V.

Journal:

The Journal of Physical Chemistry Letters

Year:

2015

Language:

english

File:

PDF, 443 KB

english, 2015

47

Ring polymer molecular dynamics and active learning of moment tensor potential for gas-phase barrierless reactions: Application to S + H 2

Novikov, Ivan S., Shapeev, Alexander V., Suleimanov, Yury V.

Journal:

The Journal of Chemical Physics

Year:

2019

File:

PDF, 2.07 MB

2019

48

VTST and RPMD kinetics study of the nine-body X + C2H6 (X â¡ H, Cl, F) reactions based on analytical potential energy surfaces

Espinosa-Garcia, J, Garcia-Chamorro, Moises, Corchado, Jose Carlos, Bhowmick, Somnath, Suleimanov, Yury

Journal:

Physical Chemistry Chemical Physics

Year:

2020

File:

PDF, 1.95 MB

2020

49

[IEEE 2016 IEEE 36th International Conference on Electronics and Nanotechnology (ELNANO) - Kyiv, Ukraine (2016.4.19-2016.4.21)] 2016 IEEE 36th International Conference on Electronics and Nanotechnology (ELNANO) - Magnetic resonance signal processing tool for diagnostic classification

Suleimanov, Yuri, Radchenko, Sergiy, Lefterov, Oleksandr, Netreba, Andriy, Vasnyov, Serhiy, Sava, Vasyl, Sanchez-Ramos, Juan, Prockop, Leon, Duara, Ranjan

Year:

2016

Language:

english

File:

PDF, 789 KB

english, 2016

50

SCOPA and META-SCOPA: software for the analysis and aggregation of genome-wide association studies of multiple correlated phenotypes

Mägi, Reedik, Suleimanov, Yury V., Clarke, Geraldine M., Kaakinen, Marika, Fischer, Krista, Prokopenko, Inga, Morris, Andrew P.

Journal:

BMC Bioinformatics

Year:

2017

Language:

english

File:

PDF, 880 KB

english, 2017

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