User:Carl McBride

Current Information - Education

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Google me! - Google Scholar - Arxiv papers - Journal papers on Scitation

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Current Information

Me.

Position: Post-doctoral researcher
Institution: Universidad Complutense de Madrid
Research group: Grupo de Termodinámica Estadística de Fluidos Moleculares
Homepage: Carl McBride
ResearcherID A-7896-2008
Email: See my home page.

Education

Undergraduate
Institution: University of Bath 1990-1993
Post-graduate
Institution: University of Salford 1993-1995
Doctoral thesis
Institution: University of Durham 1996-1999
Thesis supervisors: Dr. Mark. R. Wilson and Prof. Judith A. K. Howard, CBE, FRS
Thesis title: Computer Simulation of Liquid Crystals

Publications list

1. Carl McBride, Mark R. Wilson and Judith A. K. Howard "Molecular dynamics simulations of liquid crystal phases using atomistic potentials", Molecular Physics 93 pp. 955-964 (1998)
2. Carl McBride and Mark R. Wilson "Molecular dynamics simulations of a flexible liquid crystal", Molecular Physics 97 pp. 511 - 522 (1999)
3. Mark R. Wilson, Melanie J. Cook and Carl McBride "Atomistic Modelling of Liquid Crystal Phases", NATO Advanced Study Institute: Science Series C: Mathematical and Physical Sciences 545 Chapter 10 (1999). ISBN 978-0-7923-6099-5
4. Carlos Menduiña, Carl McBride and Carlos Vega "The second virial coefficient of quadrupolar two center Lennard-Jones models", Physical Chemistry Chemical Physics 3 1289 - 1296 (2001)
5. Carl McBride, Carlos Vega, and Luis G. MacDowell "Isotropic-nematic phase transition: Influence of intramolecular flexibility using a fused hard sphere model", Physical Review E 64 011703 (2001)
6. Carlos Vega, Carl McBride, and Luis G. MacDowell "Liquid crystal phase formation for the linear tangent hard sphere model from Monte Carlo simulations", Journal of Chemical Physics 115 pp. 4203-4211 (2001)
7. Carl McBride and Carlos Vega "Fluid solid equilibrium for two dimensional tangent hard disk chains from Wertheim's perturbation theory", Journal of Chemical Physics 116 pp. 1757-1759 (2002)
8. Carlos Vega, Carl McBride and Luis G. MacDowell "The effect of flexibility on the phase diagram of simple molecular models", Physical Chemistry Chemical Physics4 pp. 853 - 862 (2002)
9. Carlos Vega and Carl McBride "Scaling laws for the equation of state of flexible and linear tangent hard sphere chains", Physical Review E 65 052501 (2002)
10. Carlos Vega, Carl McBride and Carlos Menduiña "The second virial coefficient of the dipolar two center Lennard-Jones model", Physical Chemistry Chemical Physics 4 pp. 3000 - 3007 (2002)
11. Carl McBride and Carlos Vega "A Monte Carlo study of the influence of molecular flexibility on the phase diagram of a fused hard sphere model", Journal of Chemical Physics 117 pp. 10370-10379 (2002)
12. Juan J. Freire and Carl McBride "Mesophase Formation in Solutions of Diblock Copolymers Simulated Using the Bond Fluctuation Model", Macromolecular Theory and Simulations 12 pp. 237 - 242 (2003)
13. C. Vega, C. McBride, E. de Miguel, F. J. Blas and A. Galindo "The phase diagram of the two center Lennard-Jones model as obtained from computer simulation and Wertheim's thermodynamic perturbation theory", Journal of Chemical Physics 118 pp. 10696-10706 (2003)
14. Carlos Vega, José L. F. Abascal, Carl McBride and Fernando Bresme "The fluid–solid equilibrium for a charged hard sphere model revisited", Journal of Chemical Physics 119 pp. 964-971 (2003)
15. Eduardo Sanz, Carl McBride and Carlos Vega "The properties of fully flexible Lennard-Jones chains in the solid phase: Wertheim theory and simulation", Molecular Physics 101 pp. 2241-2255 (2003)
16. José L. F. Abascal, Carlos Vega, Carl McBride and Fernando Bresme "Characterization of the order-disorder transition of a charged hard-sphere model", Physical Review E 68 052501 (2003)
17. Carlos Vega, Luis G. MacDowell, Carl McBride, Felipe J. Blas, Amparo Galindo and Eduardo Sanz "Molecular modeling of flexible molecules. Vapor–liquid and fluid–solid equilibria" Journal of Molecular Liquids 113 pp. 37-51 (2004)
18. Carl McBride, Carlos Vega, Eduardo Sanz, and Jose L. F. Abascal "Formation of high density amorphous ice by decompression of ice VII and ice VIII at 135 K", Journal of Chemical Physics 121 pp. 11907-11911 (2004)
19. Carl McBride, Carlos Vega, Eduardo Sanz, Luis G. MacDowell and Jose L. F. Abascal "The range of meta stability of ice-water melting for two simple models of water", Molecular Physics 103 pp. 1 - 5 (2005)
20. Carlos Vega, Carl McBride, Eduardo Sanz and Jose L. F. Abascal "Radial distribution functions and densities for the SPC/E, TIP4P and TIP5P models for liquid water and ices Ih, Ic, II, III, IV, V, VI, VII, VIII, IX, XI and XII", Physical Chemistry Chemical Physics 7 pp. 1450-1456 (2005)
21. Carl McBride, Carlos Vega, and Eduardo Sanz "Non-Markovian melting: a novel procedure to generate initial liquid like phases for small molecules for use in computer simulation studies", Computer Physics Communications 170 pp. 137-143 (2005)
22. Carlos Vega, José L. F. Abascal, Eduardo Sanz, Luis G. MacDowell and C arl McBride "Can simple models describe the phase diagram of water?", Journal of Physics: Condensed Matter 17 pp. S3283-S3288 (2005)
23. Carl McBride "Computers and Liquid State Statistical Mechanics" Nova Science Publishers Inc., New York: "Computer Physics Research Trends" (2007) ISBN 1-60021-595-5 (arXiv.org)
24. Carl McBride and Enrique Lomba "Hard biaxial ellipsoids revisited: Numerical results", Fluid Phase Equilibria 255 pp. 37-45 (2007)
25. E. Lomba, N. G. Almarza, C. Martín, and C. McBride "Phase behavior of attractive and repulsive ramp fluids: Integral equation and computer simulation studies", Journal of Chemical Physics 126 244510 (2007)
26. Carl McBride "wikiFactor: a measure of the importance of a wiki site", arXiv:0902.3439 19 Feb (2009)
27. Helena L. Pi, Juan L. Aragones, Carlos Vega, Eva G. Noya, Jose L. F. Abascal, Miguel A. Gonzalez and Carl McBride "Anomalies in water as obtained from computer simulations of the TIP4P/2005 model: density maxima, and density, isothermal compressibility and heat capacity minima", Molecular Physics 107 pp. 365-374 (2009)
28. Carl McBride, Carlos Vega, Eva G. Noya, Rafael Ramirez, Luis M. Sese "Quantum contributions in the ice phases: the path to a new empirical model for water -- TIP4PQ/2005", Journal of Chemical Physics 131 024506 (2009)
29. C. Vega, M. M. Conde, C. McBride, J. L. F. Abascal, E. G. Noya, R. Ramirez, and L. M. Sesé "Heat capacity of water: A signature of nuclear quantum effects", Journal of Chemical Physics 132 046101 (2010)
30. Maria M. Conde, Carlos Vega, Carl McBride, Eva G. Noya, Rafael Ramírez, and Luis M. Sesé "Can gas hydrate structures be described using classical simulations?", Journal of Chemical Physics 132 114503 (2010)

Misc.

• User:Carl McBride/Tools
• My Erdös Number is 5
• User:Carl McBride/Sandbox1