Modeling and simulation of nuclear fuel materials

被引：70

作者：

Devanathan, Ram ^{[1
]}

Van Brutzel, Laurent ^{[2
]}

Chartier, Alain ^{[2
]}

Gueneau, Christine ^{[2
]}

Mattsson, Ann E. ^{[3
]}

Tikare, Veena ^{[3
]}

Bartel, Timothy ^{[3
]}

Besmann, Theodore ^{[4
]}

Stan, Marius ^{[5
]}

Van Uffelen, Paul ^{[6
]}

机构：

[1] Pacific NW Natl Lab, Richland, WA 99352 USA

[2] CEA, Serv Chim Phys, F-91191 Gif Sur Yvette, France

[3] Sandia Natl Labs, Albuquerque, NM 87185 USA

[4] Oak Ridge Natl Lab, Oak Ridge, TN USA

[5] Los Alamos Natl Lab, Los Alamos, NM USA

[6] Commiss European Communities, Joint Res Ctr, Inst Transuranium Elements, D-7500 Karlsruhe, Germany

来源：

ENERGY & ENVIRONMENTAL SCIENCE | 2010年 / 3卷 / 10期

关键词：

MOLECULAR-DYNAMICS SIMULATION; CHEMICAL THERMODYNAMIC REPRESENTATION; TEMPERATURE-ACCELERATED DYNAMICS; PHASE-FIELD MODEL; COMPUTER-SIMULATION; POINT-DEFECTS; ELECTRONIC-STRUCTURE; URANIUM-DIOXIDE; GRAIN-GROWTH; INTERATOMIC POTENTIALS;

D O I：

10.1039/c0ee00028k

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

We review the state of modeling and simulation of nuclear fuels with emphasis on the most widely used nuclear fuel, UO2. The hierarchical scheme presented represents a science-based approach to modeling nuclear fuels by progressively passing information in several stages from electronic structure calculations to continuum level simulations. Such an approach is essential to overcome the challenges posed by radioactive materials handling, experimental limitations in modeling extreme conditions and accident scenarios, and the small time and distance scales of fundamental processes. When used in conjunction with experimental validation, this multiscale modeling scheme can provide valuable guidance to development of fuel for advanced reactors to meet rising global energy demand.

引用

页码：1406 / 1426

页数：21

共 50 条

[41] Promising Fuel Materials for Thermionic Nuclear Power Installations
Alekseev, S. V.
Vybyvanets, V. I.
Gontar', A. S.
Lyubimov, D. Yu.
Nelidov, M. V.
ATOMIC ENERGY, 2014, 115 (06) : 391 - 401
[42] Modeling and simulation of fuel cell hybrid vehicles
H. Yun
Y. Zhao
J. Wang
International Journal of Automotive Technology, 2010, 11 : 223 - 228
[43] Comprehensive Comparison of Nuclear Materials in BNPP Fuel Assemblies
Papi, Zahra
Khoshahval, Farrokh
NUCLEAR TECHNOLOGY, 2023, 209 (07) : 1050 - 1067
[44] Electronic correlation and transport properties of nuclear fuel materials
Yin, Quan
Kutepov, Andrey
Haule, Kristjan
Kotliar, Gabriel
Savrasov, Sergey Y.
Pickett, Warren E.
PHYSICAL REVIEW B, 2011, 84 (19)
[45] NUCLEAR-MATERIALS SAFEGUARDS AND FUEL CYCLE INDUSTRY
IMAI, R
NUCLEAR ENGINEERING INTERNATIONAL, 1975, 20 (234): : 679 - 681
[46] JACKET MATERIALS FOR FUEL ELEMENTS OF FAST NUCLEAR REACTORS
BOHM, H
BRENNSTOFF-WARME-KRAFT, 1969, 21 (07): : 383 - &
[47] Verification of nuclear materials of the fuel fabrication laboratory at Inshas
El-Mongy, SA
El-Hakim, E
El-Tahawy, MS
PROCEEDINGS OF THE SIXTH INTERNATIONAL CONFERENCE ON FACILITY OPERATIONS-SAFEGUARDS INTERFACE, 1999, : 250 - 256
[48] Container materials in environments of corroded spent nuclear fuel
Huang, FH
JOURNAL OF NUCLEAR MATERIALS, 1996, 231 (1-2) : 74 - 82
[49] Promising Fuel Materials for Thermionic Nuclear Power Installations
S. V. Alekseev
V. I. Vybyvanets
A. S. Gontar’
D. Yu. Lyubimov
M. V. Nelidov
Atomic Energy, 2014, 115 : 391 - 401
[50] Modeling and Simulation for A Fuel Cell Powered Scooter
Chao, Chung-Using
JOURNAL OF THE CHINESE SOCIETY OF MECHANICAL ENGINEERS, 2011, 32 (05): : 439 - 446

← 1 2 3 4 5 →