Literature DB >> 24187949

The kinetic Monte Carlo method as a way to solve the master equation for interstellar grain chemistry.

H M Cuppen1, L J Karssemeijer, T Lamberts.   

Abstract

Entities:  

Year:  2013        PMID： 24187949      PMCID： PMC3934372          DOI： 10.1021/cr400234a

Source DB:  PubMed          Journal:  Chem Rev        ISSN： 0009-2665            Impact factor:   60.622


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  32 in total

1.  Comparison of methods for finding saddle points without knowledge of the final states.

Authors:  R A Olsen; G J Kroes; G Henkelman; A Arnaldsson; H Jónsson
Journal:  J Chem Phys       Date:  2004-11-22       Impact factor: 3.488

2.  Long-timescale simulations of diffusion in molecular solids.

Authors:  L J Karssemeijer; A Pedersen; H Jónsson; H M Cuppen
Journal:  Phys Chem Chem Phys       Date:  2012-07-10       Impact factor: 3.676

3.  Efficient methods for finding transition states in chemical reactions: comparison of improved dimer method and partitioned rational function optimization method.

Authors:  Andreas Heyden; Alexis T Bell; Frerich J Keil
Journal:  J Chem Phys       Date:  2005-12-08       Impact factor: 3.488

4.  Adaptive kinetic Monte Carlo for first-principles accelerated dynamics.

Authors:  Lijun Xu; Graeme Henkelman
Journal:  J Chem Phys       Date:  2008-09-21       Impact factor: 3.488

5.  The Monte Carlo method.

Authors:  N METROPOLIS; S ULAM
Journal:  J Am Stat Assoc       Date:  1949-09       Impact factor: 5.033

6.  Mechanism of the initial stage of silicate oligomerization.

Authors:  Xue-Qing Zhang; Thuat T Trinh; Rutger A van Santen; Antonius P J Jansen
Journal:  J Am Chem Soc       Date:  2011-04-12       Impact factor: 15.419

7.  Clustering of chemisorbed H(D) atoms on the graphite (0001) surface due to preferential sticking.

Authors:  L Hornekaer; E Rauls; W Xu; Z Sljivancanin; R Otero; I Stensgaard; E Laegsgaard; B Hammer; F Besenbacher
Journal:  Phys Rev Lett       Date:  2006-10-31       Impact factor: 9.161

8.  Water formation at low temperatures by surface O2 hydrogenation I: Characterization of ice penetration.

Authors:  S Ioppolo; H M Cuppen; C Romanzin; E F van Dishoeck; H Linnartz
Journal:  Phys Chem Chem Phys       Date:  2010-08-09       Impact factor: 3.676

9.  Understanding adsorption of hydrogen atoms on graphene.

Authors:  Simone Casolo; Ole Martin Løvvik; Rocco Martinazzo; Gian Franco Tantardini
Journal:  J Chem Phys       Date:  2009-02-07       Impact factor: 3.488

10.  An embedded cluster study of the formation of water on interstellar dust grains.

Authors:  T P M Goumans; C Richard A Catlow; Wendy A Brown; Johannes Kästner; Paul Sherwood
Journal:  Phys Chem Chem Phys       Date:  2009-04-23       Impact factor: 3.676
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  1 in total

1.  A radiobiological model of radiotherapy response and its correlation with prognostic imaging variables.

Authors:  Mireia Crispin-Ortuzar; Jeho Jeong; Andrew N Fontanella; Joseph O Deasy
Journal:  Phys Med Biol       Date:  2017-01-31       Impact factor: 3.609
  1 in total

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