Open AccessThe use of molecular dynamics for the thermodynamic properties of simple and transition metals
Author(s) -
Galen K. Straub
Publication year - 1987
Publication title -
osti oai (u.s. department of energy office of scientific and technical information)
Language(s) - English
Resource type - Reports
DOI - 10.2172/6687574
Subject(s) - molecular dynamics , helmholtz free energy , anharmonicity , thermodynamic integration , thermodynamics , adiabatic process , chemistry , pair potential , potential energy , phase transition , canonical ensemble , statistical physics , physics , computational chemistry , classical mechanics , condensed matter physics , statistics , mathematics , monte carlo method
Accelerating Research
Robert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom
Address
John Eccles HouseRobert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom