Van Erp, Titus S.: search on Z-Library

The world's largest scientific articles store. 70,000,000+ articles for free.

Don't use scam websites

1

PyRETIS: A well-done, medium-sized python library for rare events

Lervik, Anders, Riccardi, Enrico, van Erp, Titus S.

Journal:

Journal of Computational Chemistry

Year:

2017

Language:

english

File:

PDF, 1.36 MB

english, 2017

2

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

3

Ab Initio Molecular Dynamics Study on the Interactions between Carboxylate Ions and Metal Ions in Water

Mehandzhiyski, Aleksandar Y., Riccardi, Enrico, van Erp, Titus S., Trinh, Thuat T., Grimes, Brian A.

Journal:

Journal of Physical Chemistry B

Year:

2015

Language:

english

File:

PDF, 2.61 MB

english, 2015

4

Investigation of the Mechanism of Colloidal Silicalite-1 Crystallization by Using DLS, SAXS, and 29Si NMR Spectroscopy

Alexander Aerts, Mohamed Haouas, Tom P. Caremans, Lana R. A. Follens, Titus S. van Erp, Francis Taulelle, Jan Vermant, Johan A. Martens, Christine E. A. Kirschhock

Journal:

Chemistry - A European Journal

Year:

2010

Language:

english

File:

PDF, 547 KB

english, 2010

5

Efficient path sampling on multiple reaction channels

Titus S. van Erp

Journal:

Computer Physics Communications

Year:

2008

Language:

english

File:

PDF, 733 KB

english, 2008

6

A novel path sampling method for the calculation of rate constants

van Erp, Titus S., Moroni, Daniele, Bolhuis, Peter G.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 693 KB

english, 2003

7

van Erp et al. Reply:

van Erp, Titus S., Cuesta-Lopez, Santiago, Hagmann, Johannes-Geert, Peyrard, Michel

Journal:

Physical Review Letters

Year:

2006

Language:

english

File:

PDF, 36 KB

english, 2006

8

29 Si NMR and UV−Raman Investigation of Initial Oligomerization Reaction Pathways in Acid-Catalyzed Silica Sol−Gel Chemistry

Depla, Anouschka, Lesthaeghe, David, van Erp, Titus S., Aerts, Alexander, Houthoofd, Kristof, Fan, Fengtao, Li, Can, Van Speybroeck, Veronique, Waroquier, Michel, Kirschhock, Christine E. A., Martens,

Journal:

The Journal of Physical Chemistry C

Year:

2011

Language:

english

File:

PDF, 2.18 MB

english, 2011

9

Rare event simulations reveal subtle key steps in aqueous silicate condensation

Moqadam, Mahmoud, Eiccardi, Enrico, Trinh, Thuat T, Lervik, Anders, van Erp, Titus

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 8.78 MB

english, 2017

10

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

11

Breakdown of Lindstedt expansion for chaotic maps

Gentile, Guido, van Erp, Titus S.

Journal:

Journal of Mathematical Physics

Year:

2005

Language:

english

File:

PDF, 562 KB

english, 2005

12

On the relation between the Langmuir and thermodynamic flux equations

van Erp, Titus S., Trinh, Thuat, Kjelstrup, Signe, Glavatskiy, Kirill S.

Journal:

Frontiers in Physics

Year:

2014

Language:

english

File:

PDF, 2.40 MB

english, 2014

13

Enantioselective adsorption of ibuprofen and lysine in metal–organic frameworks

Bueno-Perez, Rocio, Martin-Calvo, Ana, Gómez-Álvarez, Paula, Gutiérrez-Sevillano, Juan J., Merkling, Patrick J., Vlugt, Thijs J. H., van Erp, Titus S., Dubbeldam, David, Calero, Sofia

Journal:

Chemical Communications

Year:

2014

Language:

english

File:

PDF, 1.76 MB

english, 2014

14

Rate constants for diffusive processes by partial path sampling

Moroni, Daniele, Bolhuis, Peter G., van Erp, Titus S.

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 383 KB

english, 2004

15

Heat and Mass Transfer across Interfaces in Complex Nanogeometries

Wilhelmsen, Øivind, Trinh, Thuat T., Kjelstrup, Signe, van Erp, Titus S., Bedeaux, Dick

Journal:

Physical Review Letters

Year:

2015

Language:

english

File:

PDF, 680 KB

english, 2015

16

A test on reactive force fields for the study of silica dimerization reactions

Moqadam, Mahmoud, Riccardi, Enrico, Trinh, Thuat T., Åstrand, Per-Olof, van Erp, Titus S.

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 3.15 MB

english, 2015

17

Density Functional Theory Study on the Interactions of Metal Ions with Long Chain Deprotonated Carboxylic Acids

Mehandzhiyski, Aleksandar Y., Riccardi, Enrico, van Erp, Titus S., Koch, Henrik, Åstrand, Per-Olof, Trinh, Thuat T., Grimes, Brian A.

Journal:

Journal of Physical Chemistry A

Year:

2015

Language:

english

File:

PDF, 3.22 MB

english, 2015

18

Multiscale partial charge estimation on graphene for neutral, doped and charged flakes

Maslechko, Anastasiia, Verstraelen, Toon, van Erp, Titus S., Riccardi, Enrico

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 4.30 MB

english, 2018

19

Elaborating Transition Interface Sampling Methods

Titus S. van Erp, Peter G. Bolhuis

Journal:

Year:

2004

File:

PDF, 7 KB

2004

20

Analyzing complex reaction mechanisms using path sampling

van Erp, Titus S., Moqadam, Mahmoud, Riccardi, Enrico, Lervik, Anders

Journal:

Journal of Chemical Theory and Computation

Year:

2016

Language:

english

File:

PDF, 2.20 MB

english, 2016

21

Continuous Synthesis Process of Hexagonal Nanoplates of P 6 m Ordered Mesoporous Silica

Jammaer, Jasper, van Erp, Titus S., Aerts, Alexander, Kirschhock, Christine E. A., Martens, Johan A.

Journal:

Journal of the American Chemical Society

Year:

2011

Language:

english

File:

PDF, 2.58 MB

english, 2011

22

Local initiation conditions for water autoionization

Moqadam, Mahmoud, Lervik, Anders, Riccardi, Enrico, Venkatraman, Vishwesh, Alsberg, Bjørn Kåre, van Erp, Titus S.

Journal:

Proceedings of the National Academy of Sciences

Year:

2018

Language:

english

File:

PDF, 1.40 MB

english, 2018

23

Diffusion of gas mixtures in the sI hydrate structure

Waage, Magnus H., Trinh, Thuat T., van Erp, Titus S.

Journal:

The Journal of Chemical Physics

Year:

2018

Language:

english

File:

PDF, 2.37 MB

english, 2018

24

Reaction Rate Calculation by Parallel Path Swapping

van Erp, Titus S.

Journal:

Physical Review Letters

Year:

2007

Language:

english

File:

PDF, 414 KB

english, 2007

25

Low barriers for hydrogen diffusion in sII clathrate

Trinh, Thuat T., Waage, Magnus H., van Erp, Titus S., Kjelstrup, Signe

Journal:

Physical Chemistry Chemical Physics

Year:

2015

Language:

english

File:

PDF, 1.87 MB

english, 2015

26

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

27

Enantioselective Adsorption in Achiral Zeolites

Titus S. van Erp, Tom P. Caremans, David Dubbeldam, Ana Martin-Calvo, Sofia Calero, Johan A. Martens

Journal:

Angewandte Chemie International Edition

Year:

2010

Language:

english

File:

PDF, 721 KB

english, 2010

28

The dynamics of the DNA denaturation transition

van Erp, Titus S., Peyrard, Michel

Journal:

EPL (Europhysics Letters)

Year:

2012

Language:

english

File:

PDF, 204 KB

english, 2012

29

Molecular structure and solubility determination of asphaltenes

Ok, Salim, Mahmoodinia, Mehdi, Rajasekaran, Navvamani, Sabti, Mohamed A., Lervik, Anders, van Erp, Titus S., Cabriolu, Raffaela

Journal:

Year:

2019

Language:

english

File:

PDF, 1.59 MB

english, 2019

30

Kinetics of intermediate-mediated self-assembly in nanosized materials: A generic model

Lutsko, James F., Basios, Vasileios, Nicolis, Grégoire, Caremans, Tom P., Aerts, Alexander, Martens, Johan A., Kirschhock, Christine E. A., van Erp, Titus S.

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 523 KB

english, 2010

31

Enantioselective Adsorption Characteristics of Aluminum-Substituted MFI Zeolites

Caremans, Tom P., van Erp, Titus S., Dubbeldam, David, Castillo, Juan Manuel, Martens, Johan A., Calero, Sofia

Journal:

Chemistry of Materials

Year:

2010

Language:

english

File:

PDF, 3.96 MB

english, 2010

32

A standardization for BET fitting of adsorption isotherms

Titus S. van Erp, Johan A. Martens

Journal:

Microporous and Mesoporous Materials

Year:

2011

Language:

english

File:

PDF, 473 KB

english, 2011

33

Effective Monte Carlo Scheme for Multicomponent Gas Adsorption and Enantioselectivity in Nanoporous Materials

van Erp, Titus S., Dubbeldam, David, Caremans, Tom P., Calero, Sofia, Martens, Johan. A.

Journal:

The Journal of Physical Chemistry Letters

Year:

2010

Language:

english

File:

PDF, 1.28 MB

english, 2010

34

van Erp et al. Reply:

van Erp, Titus S., Cuesta-Lopez, Santiago, Hagmann, Johannes-Geert, Peyrard, Michel

Journal:

Physical Review Letters

Year:

2006

Language:

english

File:

PDF, 35 KB

english, 2006

35

Proton-Assisted Ethylene Hydration in Aqueous Solution

Titus S. van Erp, Evert Jan Meijer

Journal:

Angewandte Chemie

Year:

2004

Language:

english

File:

PDF, 240 KB

english, 2004

36

Elaborating transition interface sampling methods

Titus S. van Erp, Peter G. Bolhuis

Journal:

Journal of Computational Physics

Year:

2005

Language:

english

File:

PDF, 392 KB

english, 2005

37

Prospects of transition interface sampling simulations for the theoretical study of zeolite synthesis

Van Erp, Titus S., Caremans, Tom P., Kirschhock, Christine E. A., Martens, Johan A.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 831 KB

english, 2007

38

Mesoscopic modeling of DNA denaturation rates: Sequence dependence and experimental comparison

Dahlen, Oda, van Erp, Titus S.

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 4.42 MB

english, 2015

39

On the application of chiral amplification via adsorption

Titus S. van Erp, David Dubbeldam, Sofia Calero, Johan A. Martens

Journal:

Chemical Engineering Science

Year:

2010

Language:

english

File:

PDF, 950 KB

english, 2010

40

Enantioselective Adsorption in Achiral Zeolites

Titus S. van Erp, Tom P. Caremans, David Dubbeldam, Ana Martin-Calvo, Sofia Calero, Johan A. Martens

Journal:

Angewandte Chemie

Year:

2010

Language:

english

File:

PDF, 702 KB

english, 2010

41

Molecular Dynamics in Principal Component Space

Michielssens, Servaas, van Erp, Titus S., Kutzner, Carsten, Ceulemans, Arnout, de Groot, Bert L.

Journal:

Journal of Physical Chemistry B

Year:

2012

Language:

english

File:

PDF, 830 KB

english, 2012

42

Enantiomeric Adsorption of Lactic Acid Mixtures in Achiral Zeolites

Martin-Calvo, Ana, Calero, Sofía, Martens, Johan A., van Erp, Titus S.

Journal:

The Journal of Physical Chemistry C

Year:

2014

Language:

english

File:

PDF, 3.06 MB

english, 2014

43

Investigation of Nanoparticles Occurring in the Colloidal Silicalite-1 Zeolite Crystallization Process Using Dissolution Experiments

Caremans, Tom P., Loppinet, Benoit, Follens, Lana R. A., van Erp, Titus S., Vermant, Jan, Goderis, Bart, Kirschhock, Christine E. A., Martens, Johan A., Aerts, Alexander

Journal:

Chemistry of Materials

Year:

2010

Language:

english

File:

PDF, 2.11 MB

english, 2010

44

Can One Predict DNA Transcription Start Sites by Studying Bubbles?

van Erp, Titus S., Cuesta-Lopez, Santiago, Hagmann, Johannes-Geert, Peyrard, Michel

Journal:

Physical Review Letters

Year:

2005

Language:

english

File:

PDF, 351 KB

english, 2005

45

Adsorption of Polar Enantiomers in Achiral Zeolites

Martin-Calvo, Ana, Calero, Sofia, Martens, Johan. A., van Erp, Titus S.

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 1.04 MB

english, 2013

46

Simultaneous computation of free energies and kinetics of rare events

Moroni, Daniele, van Erp, Titus S., Bolhuis, Peter G.

Journal:

Physical Review E

Year:

2005

Language:

english

File:

PDF, 211 KB

english, 2005

47

Investigating rare events by transition interface sampling

Daniele Moroni, Titus S. van Erp, Peter G. Bolhuis

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

2004

Language:

english

File:

PDF, 201 KB

english, 2004

48

Ab initio molecular dynamics study of liquid methanol

Jan-Willem Handgraaf, Titus S van Erp, Evert Jan Meijer

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 194 KB

english, 2003

49

Efficiency analysis of reaction rate calculation methods using analytical models I: The two-dimensional sharp barrier

van Erp, Titus S.

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 712 KB

english, 2006

50

Improving the mesoscopic modeling of DNA denaturation dynamics

Marty-Roda, Marta, Dahlen, Oda, van Erp, Titus Sebastiaan, Cuesta-López, Santiago

Journal:

Physical Biology

Year:

2018

Language:

english

File:

PDF, 549 KB

english, 2018

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Z-Library Since 2009 support@z-lib.do

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски