Literature DB >> 10045671

Reconstruction of NaCl surfaces from a dipolar solution to the Madelung problem.

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Abstract

Entities:  

Year:  1992        PMID： 10045671     DOI： 10.1103/PhysRevLett.68.3315

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN： 0031-9007            Impact factor:   9.161


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  7 in total

1.  Long-range electrostatic corrections in multipolar/polarizable QM/MM simulations.

Authors:  Eric G Kratz; Robert E Duke; G Andrés Cisneros
Journal:  Theor Chem Acc       Date:  2016-06-17       Impact factor: 1.702

2.  Non-Ewald methods: theory and applications to molecular systems.

Authors:  Ikuo Fukuda; Haruki Nakamura
Journal:  Biophys Rev       Date:  2012-08-02

3.  A homologous series of structures on the surface of SrTiO3(110).

Authors:  James A Enterkin; Arun K Subramanian; Bruce C Russell; Martin R Castell; Kenneth R Poeppelmeier; Laurence D Marks
Journal:  Nat Mater       Date:  2010-02-14       Impact factor: 43.841

4.  Treating electrostatics with Wolf summation in combined quantum mechanical and molecular mechanical simulations.

Authors:  Pedro Ojeda-May; Jingzhi Pu
Journal:  J Chem Phys       Date:  2015-11-07       Impact factor: 3.488

5.  Schottky barrier at graphene/metal oxide interfaces: insight from first-principles calculations.

Authors:  Kai Cheng; Nannan Han; Yan Su; Junfeng Zhang; Jijun Zhao
Journal:  Sci Rep       Date:  2017-02-06       Impact factor: 4.379

6.  Interlayer cation exchange stabilizes polar perovskite surfaces.

Authors:  Daniel E E Deacon-Smith; David O Scanlon; C Richard A Catlow; Alexey A Sokol; Scott M Woodley
Journal:  Adv Mater       Date:  2014-09-05       Impact factor: 30.849

7.  Novel Unexpected Reconstructions of (100) and (111) Surfaces of NaCl: Theoretical Prediction.

Authors:  Alexander G Kvashnin; Dmitry G Kvashnin; Artem R Oganov
Journal:  Sci Rep       Date:  2019-10-03       Impact factor: 4.379
  7 in total

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