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1

Hydration of methanol in water. A DFT-based molecular dynamics study

Titus S. van Erp, Evert Jan Meijer

Journal:

Chemical Physics Letters

Year:

2001

Language:

english

File:

PDF, 217 KB

english, 2001

2

Improved long-range reactive bond-order potential for carbon. I. Construction

Los, Jan, Ghiringhelli, Luca, Meijer, Evert, Fasolino, A.

Journal:

Physical Review B

Year:

2005

Language:

english

File:

PDF, 230 KB

english, 2005

3

Precisely Tailoring Upconversion Dynamics via Energy Migration in Core-Shell Nanostructures

Zuo, Jing, Sun, Dapeng, Tu, Langping, Wu, Yanni, Cao, Yinghui, Xue, Bin, Zhang, Youlin, Chang, Yulei, Liu, Xiaomin, Kong, Xianggui, Buma, Wybren Jan, Meijer, Evert Jan, Zhang, Hong

Journal:

Angewandte Chemie International Edition

Year:

2018

Language:

english

File:

PDF, 1.01 MB

english, 2018

4

Understanding the Role of Water in Aqueous Ruthenium-Catalyzed Transfer Hydrogenation of Ketones.

Anna Pavlova, Prof. Evert Jan Meijer

Journal:

Year:

2012

Language:

english

File:

PDF, 1000 KB

english, 2012

5

Mechanistic Aspects of Using Formate as a Hydrogen Donor in Aqueous Transfer Hydrogenation

Pavlova, Anna, Rösler, Ernst, Meijer, Evert Jan

Journal:

Year:

2016

Language:

english

File:

PDF, 1.01 MB

english, 2016

6

Computer simulation of colloid-polymer mixtures

Evert Jan Meijer, Daan Frenkel

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1995

Language:

english

File:

PDF, 405 KB

english, 1995

7

Understanding hydration of Zn2+ in hydrothermal fluids with ab initio molecular dynamics

Liu, Xiandong, Lu, Xiancai, Wang, Rucheng, Meijer, Evert Jan

Journal:

Physical Chemistry Chemical Physics

Year:

2011

Language:

english

File:

PDF, 1.35 MB

english, 2011

8

Colloids dispersed in polymer solutions. A computer simulation study

Meijer, Evert Jan, Frenkel, Daan

Journal:

The Journal of Chemical Physics

Year:

1994

Language:

english

File:

PDF, 1.49 MB

english, 1994

9

Mechanism studies on thermal dissociation of tri-n-octylamine hydrochloride with FTIR, TG, DSC and quantum chemical methods

DONG, CHUNHUA, SONG, XINGFU, MEIJER, EVERT JAN, CHEN, GUILAN, XU, YANXIA, YU, JIANGUO

Journal:

Journal of Chemical Sciences

Year:

2017

Language:

english

File:

PDF, 1.92 MB

english, 2017

10

Effect of Counter Ions on the Silica Oligomerization Reaction

Thuat T. Trinh, Antonius P. J. Jansen, Rutger A. van Santen, Joost VandeVondele, Evert Jan Meijer

Journal:

Year:

2009

Language:

english

File:

PDF, 428 KB

english, 2009

11

A Multiscale Modelling Approach to Elucidate the Mechanism of the Oxygen Evolution Reaction at the Hematite-Water Interface

Sinha, Vivek, Sun, Dapeng, Meijer, Evert Jan, Vlugt, Thijs JH, Bieberle-Hütter, Anja

Journal:

Faraday Discussions

Year:

2020

File:

PDF, 1.46 MB

2020

12

Acidities of confined water in interlayer space of clay minerals

Xiandong Liu, Xiancai Lu, Rucheng Wang, Evert Jan Meijer, Huiqun Zhou

Journal:

Geochimica et Cosmochimica Acta

Year:

2011

Language:

english

File:

PDF, 902 KB

english, 2011

13

Ab initio molecular dynamics study of aqueous solvation of ethanol and ethylene

van Erp, Titus S., Meijer, Evert Jan

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 557 KB

english, 2003

14

Hydration mechanisms of Cu2+: tetra-, penta- or hexa-coordinated?

Liu, Xiandong, Lu, Xiancai, Jan Meijer, Evert, Wang, Rucheng

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1.01 MB

english, 2010

15

Erratum: Improved long-range reactive bond-order potential for carbon. I. Construction [Phys. Rev. B 72 , 214102 (2005)]

Los, Jan H., Ghiringhelli, Luca M., Meijer, Evert Jan, Fasolino, A.

Journal:

Physical Review B

Year:

2006

Language:

english

File:

PDF, 29 KB

english, 2006

16

Inside Back Cover: Complex Reaction Environments and Competing Reaction Mechanisms in Zeolite Catalysis: Insights from Advanced Molecular Dynamics (Chem. Eur. J. 26/2015)

De Wispelaere, Kristof, Ensing, Bernd, Ghysels, An, Meijer, Evert Jan, Van Speybroeck, Veronique

Journal:

Chemistry - A European Journal

Year:

2015

File:

PDF, 1.02 MB

2015

17

Realistic Modeling of Ruthenium-Catalyzed Transfer Hydrogenation

Handgraaf, Jan-Willem, Meijer, Evert Jan

Journal:

Journal of the American Chemical Society

Year:

2007

Language:

english

File:

PDF, 266 KB

english, 2007

18

A Multiscale Modelling Approach to Elucidate the Mechanism of the Oxygen Evolution Reaction at the Hematite-Water Interface

Sinha, Vivek, Sun, Dapeng, Meijer, Evert Jan, Vlugt, Thijs JH, Bieberle-Hütter, Anja

Journal:

Faraday Discussions

Year:

2020

Language:

english

File:

PDF, 1.46 MB

english, 2020

19

Immunohistochemical localization of pepsinogen A and C containing cells in Barrett's oesophagus

Stephan G. M. Meuwissen, Anne Bosma, Evert Donk, Reinier Waalewijn, Gerard Pals, Jan C. Pronk, Aldur W. Eriksson, Hendrik Mullink, Chris J. L. M. Meijer

Journal:

Virchows Archiv

Year:

1988

Language:

english

File:

PDF, 714 KB

english, 1988

20

A density-functional study of the intermolecular interactions of benzene

Meijer, Evert Jan, Sprik, Michiel

Journal:

The Journal of Chemical Physics

Year:

1996

Language:

english

File:

PDF, 265 KB

english, 1996

21

A Density Functional Study of the Addition of Water to SO 3 in the Gas Phase and in Aqueous Solution

Meijer, Evert Jan, Sprik, Michiel

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 118 KB

english, 1998

22

Renal cell carcinoma: alternative nephron-sparing treatment options for small renal masses, a systematic review

Prins, Fieke M., Kerkmeijer, Linda G.W., Pronk, Anne A., Vonken, Evert-Jan P. A., Meijer, Richard P., Bex, Axel, Barendrecht, Maurits M.

Journal:

Journal of Endourology

Year:

2017

Language:

english

File:

PDF, 397 KB

english, 2017

23

Thermodynamics and Kinetics Analysis of Thermal Dissociation of Tri-n-octylamine Hydrochloride in Open System: A DFT and TGA study

Dong, Chunhua, Song, Xingfu, Zhang, Jie, Liu, Dongfan, Meijer, Evert Jan, Yu, Jianguo

Journal:

Thermochimica Acta

Year:

2018

Language:

english

File:

PDF, 1.20 MB

english, 2018

24

First Principles and Experimental 1H NMR Signatures of Solvated Ions: The Case of HCl(aq)

Tatiana Murakhtina, Jasper Heuft, Evert Jan Meijer, Daniel Sebastiani

Journal:

Year:

2006

Language:

english

File:

PDF, 187 KB

english, 2006

25

Acid dissociation mechanisms of Si(OH)4 and Al(H2O)63+ in aqueous solution

Xiandong Liu, Xiancai Lu, Evert Jan Meijer, Rucheng Wang, Huiqun Zhou

Journal:

Geochimica et Cosmochimica Acta

Year:

2010

Language:

english

File:

PDF, 415 KB

english, 2010

26

Graphitization of single-wall nanotube bundles at extreme conditions: Collapse or coalescence route

Colonna, Francesco, Fasolino, Annalisa, Meijer, Evert Jan

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 938 KB

english, 2013

27

Precisely Tailoring Upconversion Dynamics via Energy Migration in Core-Shell Nanostructures

Zuo, Jing, Sun, Dapeng, Tu, Langping, Wu, Yanni, Cao, Yinghui, Xue, Bin, Zhang, Youlin, Chang, Yulei, Liu, Xiaomin, Kong, Xianggui, Buma, Wybren Jan, Meijer, Evert Jan, Zhang, Hong

Journal:

Angewandte Chemie International Edition

Year:

2018

File:

PDF, 1.42 MB

2018

28

Mechanism of Base-Promoted Dehydrochlorination of Pentachloroethane: Concerted or Stepwise?

Liu, Xiandong, Meijer, Evert Jan

Journal:

Journal of Physical Chemistry A

Year:

2009

Language:

english

File:

PDF, 421 KB

english, 2009

29

The role of water in silicate oligomerization reaction

Trinh, Thuat T., Jansen, Antonius P. J., van Santen, Rutger A., Jan Meijer, Evert

Journal:

Physical Chemistry Chemical Physics

Year:

2009

Language:

english

File:

PDF, 1.10 MB

english, 2009

30

Location of fluid-β and β-δ coexistence lines of nitrogen by computer simulation

Meijer, Evert Jan

Journal:

The Journal of Chemical Physics

Year:

1998

Language:

english

File:

PDF, 361 KB

english, 1998

31

Ultrastrong Absorption Meets Ultraweak Absorption: Unraveling the Energy-Dissipative Routes for Dye-Sensitized Upconversion Luminescence

Xue, Bin, Wang, Dan, Tu, Langping, Sun, Dapeng, Jing, Pengtao, Chang, Yulei, Zhang, Youlin, Liu, Xiaomin, Zuo, Jing, Song, Jun, Qu, Junle, Meijer, Evert Jan, Zhang, Hong, Kong, Xianggui

Journal:

The Journal of Physical Chemistry Letters

Year:

2018

Language:

english

File:

PDF, 2.44 MB

english, 2018

32

Precisely Tailoring Upconversion Dynamics via Energy Migration in Core-Shell Nanostructures

Zuo, Jing, Sun, Dapeng, Tu, Langping, Wu, Yanni, Cao, Yinghui, Xue, Bin, Zhang, Youlin, Chang, Yulei, Liu, Xiaomin, Kong, Xianggui, Buma, Wybren Jan, Meijer, Evert Jan, Zhang, Hong

Journal:

Angewandte Chemie

Year:

2018

Language:

english

File:

PDF, 1.01 MB

english, 2018

33

Elucidating the Role of Tetraethylammonium in the Silicate Condensation Reaction from Ab Initio Molecular Dynamics Simulations

Mai, Ngoc Lan, Do, Ha T., Hoang, Nguyen Hieu, Nguyen, Anh H., Tran, Khanh-Quang, Meijer, Evert Jan, Trinh, Thuat T.

Journal:

Journal of Physical Chemistry B

Year:

2020

File:

PDF, 2.61 MB

2020

34

Proton-Assisted Ethylene Hydration in Aqueous Solution

Titus S. van Erp, Evert Jan Meijer

Journal:

Angewandte Chemie International Edition

Year:

2004

Language:

english

File:

PDF, 240 KB

english, 2004

35

High-pressure diamondlike liquid carbon

Ghiringhelli, Luca, Los, Jan, Meijer, Evert, Fasolino, A., Frenkel, Daan

Journal:

Physical Review B

Year:

2004

Language:

english

File:

PDF, 467 KB

english, 2004

36

The role of a structure directing agent tetramethylammonium template in the initial steps of silicate oligomerization in aqueous solution

Trinh, Thuat T., Tran, Khanh-Quang, Zhang, Xue-Qing, van Santen, Rutger A., Meijer, Evert Jan

Journal:

Physical Chemistry Chemical Physics

Year:

2015

Language:

english

File:

PDF, 3.00 MB

english, 2015

37

Chiral Induction Effects in Ruthenium(II) Amino Alcohol Catalysed Asymmetric Transfer Hydrogenation of Ketones: An Experimental and Theoretical Approach

Daniëlle G. I. Petra, Joost N. H. Reek, Jan-Willem Handgraaf, Evert Jan Meijer, Peter Dierkes, Paul C. J. Kamer, Johannes Brussee, Hans E. Schoemaker, Piet W. N. M. van Leeuwen

Journal:

Chemistry - A European Journal

Year:

2000

Language:

english

File:

PDF, 341 KB

english, 2000

38

Solvation of p-Coumaric Acid in Water

Leenders, Elske J. M., VandeVondele, Joost, Bolhuis, Peter G., Meijer, Evert Jan

Journal:

Journal of Physical Chemistry B

Year:

2007

Language:

english

File:

PDF, 282 KB

english, 2007

39

Role of Water in Silica Oligomerization

Trinh, Thuat T., Jansen, Antonius P. J., van Santen, Rutger A., Meijer, Evert Jan

Journal:

The Journal of Physical Chemistry C

Year:

2009

Language:

english

File:

PDF, 1.38 MB

english, 2009

40

Novel procedure to determine coexistence lines by computer simulation. Application to hard-core Yukawa model for charge-stabilized colloids

Meijer, Evert Jan, El Azhar, Fouad

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 350 KB

english, 1997

41

Simulating the phosphorus fluid–liquid phase transition up to the critical point

Ghiringhelli, Luca M, Meijer, Evert Jan

Journal:

Journal of Physics Condensed Matter

Year:

2007

Language:

english

File:

PDF, 586 KB

english, 2007

42

Acidity of edge surface sites of montmorillonite and kaolinite

Liu, Xiandong, Lu, Xiancai, Sprik, Michiel, Cheng, Jun, Meijer, Evert Jan, Wang, Rucheng

Journal:

Geochimica et Cosmochimica Acta

Year:

2013

Language:

english

File:

PDF, 1.39 MB

english, 2013

43

Influence of a confined methanol solvent on the reactivity of active sites in UiO-66

Caratelli, Chiara, Hajek, Julianna, Rogge, Sven M. J., Vandenbrande, Steven, Meijer, Evert Jan, Waroquier, Michel, Van Speybroeck, Veronique

Journal:

Year:

2017

Language:

english

File:

PDF, 2.72 MB

english, 2017

44

Insight into thermal dissociation of tri-n-octylamine hydrochloride: The key to realizing CO 2 mineralization with waste calcium/magnesium chloride liquids

Dong, Chunhua, Song, Xingfu, Zhang, Jie, Meijer, Evert Jan, Chen, Hang, Yu, Jianguo

Journal:

Energy Science & Engineering

Year:

2018

Language:

english

File:

PDF, 864 KB

english, 2018

45

Elucidating cation effects in homogeneously catalyzed formic acid dehydrogenation

Govindarajan, Nitish, Meijer, Evert Jan

Journal:

Faraday Discussions

Year:

2019

File:

PDF, 1.35 MB

2019

46

A diagnostic model for the detection of sensitization to wheat allergens was developed and validated in bakery workers

Eva Suarthana, Yvonne Vergouwe, Karel G. Moons, Jan de Monchy, Diederick Grobbee, Dick Heederik, Evert Meijer

Journal:

Journal of Clinical Epidemiology

Year:

2010

Language:

english

File:

PDF, 221 KB

english, 2010

47

Conformational Study of Z-Glu-OH and Z-Arg-OH: Dispersion Interactions versus Conventional Hydrogen Bonding

Jaeqx, Sander, Du, Weina, Meijer, Evert Jan, Oomens, Jos, Rijs, Anouk M.

Journal:

Journal of Physical Chemistry A

Year:

2013

Language:

english

File:

PDF, 2.18 MB

english, 2013

48

Improved long-range reactive bond-order potential for carbon. II. Molecular simulation of liquid carbon

Ghiringhelli, Luca M., Los, Jan H., Fasolino, A., Meijer, Evert Jan

Journal:

Physical Review B

Year:

2005

Language:

english

File:

PDF, 901 KB

english, 2005

49

Melting line of Yukawa system by computer simulation

Meijer, Evert Jan, Frenkel, Daan

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 565 KB

english, 1991

50

Impact of the Ligand Flexibility and Solvent on the O–O Bond Formation Step in a Highly Active Ruthenium Water Oxidation Catalyst

Govindarajan, Nitish, Tiwari, Ambuj, Ensing, Bernd, Meijer, Evert Jan

Journal:

Inorganic Chemistry

Year:

2018

Language:

english

File:

PDF, 1.04 MB

english, 2018

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