Simulation of Water and Ammonia at High Pressure and Temperature | a first principle study of the phase diagram

Carlo Cavazzoni (u. a.)

ISBN 10: 3838367154 / ISBN 13: 9783838367156

Published by LAP LAMBERT Academic Publishing, 2010

About this Item

Simulation of Water and Ammonia at High Pressure and Temperature | a first principle study of the phase diagram | Carlo Cavazzoni (u. a.) | Taschenbuch | 112 S. | Englisch | 2010 | LAP LAMBERT Academic Publishing | EAN 9783838367156 | Verantwortliche Person für die EU: BoD - Books on Demand, In de Tarpen 42, 22848 Norderstedt, info[at]bod[dot]de | Anbieter: preigu.

Seller Inventory # 101022085

Bibliographic Details

• Title: Simulation of Water and Ammonia at High Pressure and Temperature | a first principle study of the phase diagram
• Publisher: LAP LAMBERT Academic Publishing
• Publication Date: 2010
• Language: English
• ISBN 10: 3838367154
• ISBN 13: 9783838367156
• Binding: Taschenbuch
• Condition: Neu
• Dimensions: 220W x 150H x 7D millimeters 220 millimeters width by 150 millimeters height by 7 millimeters depth
• Weight: 185 grams
• Seller catalogs:
  • Bücher

About this title

Synopsis

In this work we present the results of extensive Constant Pressure ab-inito Molecular Dynamics simulations of Water and Ammonia at high pressures and temperatures. New superionic, ionic and metallic phases have been discovered and characterized, and consequence on planetary physics discussed. Large scale demanding ab-initio simulations to compute Water and Ammonia phase diagrams, have been possible thanks to the design and the implementation of an architecture free parallel code, ables to exploit the computational power of modern massive parallel computers.

About the Author

Born in Formigine (Modena) Italy, the 20th of May 1970. 28 July 1994, degree of "Dottore in Fisica" from the University of Modena. 24 October 1998, degree of "Doctor Philosophiae" (Ph.D.) from SISSA/ISAS of Trieste. 1999 - today, staff member of High Performance Computing Department in CINECA.