(Q46335570)

21 December 2017

http://europepmc.org/abstract/MED/24160525

title

Determining the phase diagram of water from direct coexistence simulations: the phase diagram of the TIP4P/2005 model revisited (English)

1 reference

21 December 2017

http://europepmc.org/abstract/MED/24160525

author

Carlos Vega

4

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

Miguel A. González

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

José Luis F Abascal

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

author name string

M M Conde

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

language of work or name

English

0 references

publication date

1 October 2013

1 reference

21 December 2017

http://europepmc.org/abstract/MED/24160525

published in

Journal of Chemical Physics

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

volume

139

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

issue

15

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

page(s)

154505

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

A potential model for the study of ices and amorphous water: TIP4P/Ice.

3 June 2020

cites work

1 reference

Development of an improved four-site water model for biomolecular simulations: TIP4P-Ew

21 January 2018

1 reference

A general purpose model for the condensed phases of water: TIP4P/2005

21 January 2018

1 reference

What ice can teach us about water interactions: a critical comparison of the performance of different water models.

21 January 2018

1 reference

Competing quantum effects in the dynamics of a flexible water model

21 January 2018

1 reference

New Monte Carlo method to compute the free energy of arbitrary solids. Application to the fcc and hcp phases of hard spheres

21 January 2018

1 reference

Revisiting the Frenkel-Ladd method to compute the free energy of solids: the Einstein molecule approach.

21 January 2018

1 reference

Free energy calculations for molecular solids using GROMACS.

21 January 2018

1 reference

GROMACS: fast, flexible, and free

21 January 2018

1 reference

The Structure and Entropy of Ice and of Other Crystals with Some Randomness of Atomic Arrangement

21 January 2018

1 reference

A Theory of Water and Ionic Solution, with Particular Reference to Hydrogen and Hydroxyl Ions

21 January 2018

1 reference

Dielectric constant of ices and water: a lesson about water interactions.

21 January 2018

1 reference

The melting temperature of the six site potential model of water

21 January 2018

1 reference

Melting of ice under pressure

21 January 2018

1 reference

The phase diagram of water at high pressures as obtained by computer simulations of the TIP4P/2005 model: the appearance of a plastic crystal phase.

21 January 2018

1 reference

The stability of a crystal with diamond structure for patchy particles with tetrahedral symmetry.

21 January 2018

1 reference

Canonical sampling through velocity rescaling

21 January 2018

1 reference

Isothermal-isobaric molecular dynamics using stochastic velocity rescaling.

21 January 2018

1 reference

The shear viscosity of rigid water models.

21 January 2018

1 reference

Simulating water with rigid non-polarizable models: a general perspective

21 January 2018

1 reference

Dielectric constant of ice Ih and ice V: a computer simulation study.

21 January 2018

1 reference

Comparison of simple potential functions for simulating liquid water

21 January 2018

1 reference

Direct calculation of solid-liquid interfacial free energy for molecular systems: TIP4P ice-water interface.

21 January 2018

1 reference

Ice Ih-Water Interfacial Free Energy of Simple Water Models with Full Electrostatic Interactions.

21 January 2018

1 reference

Uncovering molecular processes in crystal nucleation and growth by using molecular simulation

21 January 2018

1 reference

Solid-solid and liquid-solid phase equilibria for the restricted primitive model

21 January 2018

1 reference

Systematic improvement of a classical molecular model of water

21 January 2018

1 reference

The phase diagram of ice: a quasi-harmonic study based on a flexible water model

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.4824627

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24160525%20AND%20SRC:MED&resulttype=core&format=json

3 June 2020

arXiv ID

no value

0 references

1 reference