Atomistic Simulation studies of the Cement Paste Components

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CONFORMIDAD DEL DEPARTAMENTO El Consejo del Departamento de Química Física de la Facultad de Ciencia e Ingeniería de la Universidad del País Vasco UPV/EHU en reunión celebrada el día 9 de julio de 2009 ha acordado dar la conformidad a la admisión a trámite de presentación de la Tesis Doctoral titulada: Atomistic Simulation Studies of the Cement Paste Componentes dirigida por los Drs. Jorge Sánchez Dolado, Andrés Ayuela Fernández y Fernando López Arbeloa y presentada por Don Hegoi Manzano Moro ante este Departamento. En Leioa a 15 de Julio de 2009 Vº Bº DIRECTOR DEL DEPARTAMENTO SECRETARIO DEL DEPARTAMENTO Fdo.: Luís Manuel León Isidro Fdo.: José Luís Vilas Vilela
Page 1 and 2: Atomistic Simulation studies of the
Page 3: AUTORIZACION DEL/LA DIRECTOR/A DE T
Page 9: I believe that the scientific knowl
Page 12 and 13: think that Gorka Pascuas, Amaia Alb
Page 15 and 16: Table of Contents Table of Contents
Page 17 and 18: Table of Contents 6.4. Conclusions
Page 19 and 20: General Introduction General Introd
Page 21 and 22: General Introduction where engineer
Page 23 and 24: General Introduction Introducción
Page 25 and 26: General Introduction cementos que u
Page 27 and 28: General Introduction El capítulo 6
Page 29 and 30: Cement Chemistry Notation Cement ch
Page 31 and 32: Introduction to Cement Chemistry Ch
Page 33 and 34: Introduction to Cement Chemistry ev
Page 35 and 36: Introduction to Cement Chemistry Ta
Page 37 and 38: Introduction to Cement Chemistry (a
Page 39 and 40: Introduction to Cement Chemistry C
Page 41 and 42: Introduction to Cement Chemistry si
Page 43 and 44: Introduction to Cement Chemistry th
Page 45 and 46: Introduction to Cement Chemistry 1.
Page 47 and 48: Introduction to Cement Chemistry te
Page 49 and 50: Introduction to Cement Chemistry En
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Introduction to Cement Chemistry si
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Introduction to Cement Chemistry (a
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Introduction to Cement Chemistry di
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Overview of Atomistic Simulation Me
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Assembly of C-S-H Precursors Chapte
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Assembly of C-S-H Precursors Toberm
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Assembly of C-S-H Precursors Initia
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Assembly of C-S-H Precursors ion (e
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Assembly of C-S-H Precursors 3.4. A
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Assembly of C-S-H Precursors (a) Je
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Assembly of C-S-H Precursors b) A c
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Aluminium Incorporation to the C-S-
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Elastic Properties of the Cement Pa
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Structure, Elastic Properties and R
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Summary Summary Nowadays, the final
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Summary Al(OH) 3 condensations in p
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Summary Resumen Pese a que hoy en d
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Summary estudiado en relación con
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Appendix 1. SIESTA Pseudopotentials
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Appendix 2. Force Fields: Potential
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Appendix 3. The Stability Index App
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Appendix 3. The Stability Index The
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Appendix 4. Connectivity of the Alu
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Appendix 4. Connectivity of the Alu
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Appendix 5. Elastic Properties Calc
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Appendix 6. Lattice Parameters and
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Appendix 7. Structural Paremeters o
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List of Publications List of Public
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References References 1. Lea, F.M.
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References 26. Takeuchi, Y., F. Nis
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References 58. Jennings, H.M., et a
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References angle neutron scattering
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References 121. Faucon, P., et al.,
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References 154. Dove, M.T., Structu
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References cement for the future. C
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References 215. Brinker, C.J. and G
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References 247. de Leeuw, N.H., G.W
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References 6013-6023. 278. Smilauer
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Atomistic Simulation studies of the Cement Paste Components

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