(Q46836134)

25 December 2017

http://europepmc.org/abstract/MED/25240358

title

A new polarizable force field for alkali and halide ions (English)

1 reference

25 December 2017

http://europepmc.org/abstract/MED/25240358

author

András Baranyai

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

2 June 2020

author name string

Péter T Kiss

series ordinal

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

2 June 2020

language of work or name

English

0 references

publication date

1 September 2014

1 reference

25 December 2017

http://europepmc.org/abstract/MED/25240358

published in

Journal of Chemical Physics

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

2 June 2020

volume

141

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

2 June 2020

issue

11

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

2 June 2020

page(s)

114501

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

Effect of ions on the structure of water: structure making and breaking

2 June 2020

cites work

1 reference

Structural dynamics of aqueous salt solutions

21 January 2018

1 reference

Recent advances in molecular simulations of ion solvation at liquid interfaces

21 January 2018

1 reference

Insights into the structures, energetics, and vibrations of aqua-rubidium(I) complexes: ab initio study.

21 January 2018

1 reference

Ion solvation thermodynamics from simulation with a polarizable force field

21 January 2018

1 reference

Simulating Monovalent and Divalent Ions in Aqueous Solution Using a Drude Polarizable Force Field.

21 January 2018

1 reference

Determination of alkali and halide monovalent ion parameters for use in explicitly solvated biomolecular simulations

21 January 2018

1 reference

A transferable ab initio based force field for aqueous ions.

21 January 2018

1 reference

A systematic development of a polarizable potential of water.

21 January 2018

1 reference

Testing recent charge-on-spring type polarizable water models. I. Melting temperature and ice properties.

21 January 2018

1 reference

A Simplex Method for Function Minimization

21 January 2018

1 reference

Robust rotational-velocity-Verlet integration methods

21 January 2018

1 reference

Structures, energetics, and spectra of aqua‐sodium(I): Thermodynamic effects and nonadditive interactions

21 January 2018

1 reference

Aqua–potassium(I) complexes: Ab initio study

21 January 2018

1 reference

Structures, energetics, and spectra of aqua-cesium (I) complexes: An ab initio and experimental study

21 January 2018

1 reference

Comparative ab initio study of the structures, energetics and spectra of X[sup −]⋅(H[sub 2]O)[sub n=1–4] [X=F, Cl, Br, I] clusters

21 January 2018

1 reference

Structures and spectra of iodide–water clusters I[sup −](H[sub 2]O)[sub n=1–6]: An ab initio study

21 January 2018

1 reference

A simple polarizable model of water based on classical Drude oscillators

21 January 2018

1 reference

Determination of Electrostatic Parameters for a Polarizable Force Field Based on the Classical Drude Oscillator

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.4895129

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25240358%20AND%20SRC:MED&resulttype=core&format=json

2 June 2020

1 reference