Jose Garcia De La Vega

Prof. Jose Garcia De La Vega


Research Focus & Metrics

Academic Career Length

44Years (1983-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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21 January 2005 in The Journal of Physical Chemistry A
Verified
Journal Article
Closed access
LHL. Hermosilla
L. Hermosilla
PCP. Calle
P. Calle
JVJose Garcia De La Vega
Jose Garcia De La Vega
CSC. Sieiro
C. Sieiro

27 March 2003 in Journal of Computational Chemistry
Verified
Journal Article
Closed access
PDF file
IEI. Ema
I. Ema
JVJose Garcia De La Vega
Jose Garcia De La Vega
GRG. Ramírez
G. Ramírez
RFRafael Lopez Fernandez
Rafael Lopez Fernandez
JRJ. Fernández Rico
J. Fernández Rico
JPJ. Paldus
J. Paldus

1 December 2002 in The Journal of Physical Chemistry B
Verified
Journal Article
Closed access
GMGuillermo Martín
Guillermo Martín
GRGema Rojo
Gema Rojo
FAFernando Agulló-López
Fernando Agulló-López
VFVictor Ferro
Victor Ferro
JVJose Garcia De La Vega
Jose Garcia De La Vega
JZJoseph Zyss
Joseph Zyss

19 July 2016 in Computation
Verified
Journal Article
Open access
PDF file
KKKarl Karu
Karl Karu
ARAnton Ruzanov
Anton Ruzanov
HEHeigo Ers
Heigo Ers
VIVladislav Ivanistsev
Vladislav Ivanistsev
ILIsabel Lage-Estebanez
Isabel Lage-Estebanez
JVJose Garcia De La Vega
Jose Garcia De La Vega
Nowadays, density functional theory (DFT)-based high-throughput computational approach is becoming more efficient and, thus, attractive for finding advanced materials for electrochemical applications. In this work, we illustrate how theoretical models, computational methods, and informatics techniques can be put together to form a simple DFT-based throughput computational workflow for predicting physicochemical properties of room-temperature ionic liquids. The developed workflow has been used for screening a set of 48 ionic pairs and for analyzing the gathered data. The predicted relative electrochemical stabilities, ionic charges and dynamic properties of the investigated ionic liquids are discussed in the light of their potential practical applications.

23 November 2006 in The Journal of Physical Chemistry A
Verified
Journal Article
Closed access
LHL. Hermosilla
L. Hermosilla
PCP. Calle
P. Calle
JVJose Garcia De La Vega
Jose Garcia De La Vega
CSC. Sieiro
C. Sieiro

1 March 2003 in The Journal of Physical Chemistry A
Verified
Journal Article
Closed access
EMEva M Maya
Eva M Maya
EGEva M. García-Frutos
Eva M. García-Frutos
PVPurificación Vázquez
Purificación Vázquez
TTTomas Torres
Tomas Torres
GMGuillermo Martín
Guillermo Martín
JZJoseph Zyss
Joseph Zyss