Published 2020 | Version v1
Book Metadata-only

Comparison of molecular dynamics simulation methods of methane shock wave compression

Creators

  • 1. Natsional'nyj Issledovatel'skij Yadernyj Univ. «MIFI», Moscow (Russian Federation)

Description

Shock wave compression of methane was simulated using the molecular dynamics method with Hugoniostat and MSST approach. The calculation was carried out employing ReaxFFlg potential. We show comparison of simulated Hugoniots for pressure range 0,1-44 GPa and times required for simulation run of two different methods

Abstract (Russian)

Методом молекулярной динамики было проведено моделирование ударно-волнового сжатия метана с использованием различных методов расчета конечного состояния за ударной волной. В качестве потенциала взаимодействия использовался ReaxFFlg. Представлена ударная адиабата (P=0,1-44 ГПа), проведено сравнение времен расчета одинаковой задачи разными методами
Part of:
VI International conference «Laser, plasma research and technologies – LaPlaz-2020». Collection of scientific papers. Part 1

Additional details

Additional titles

Original title (Russian)
Сравнение методов моделирования ударно-волнового сжатия метана

Publishing Information

Publisher
NIYaU MIFI
Imprint Place
Moscow (Russian Federation)
ISBN
978-5-7262-2655-2
Imprint Title
VI International conference #Left-Pointing Double Angle Quotation Mark#Laser, plasma research and technologies #En Dash# LaPlaz-2020#Right-Pointing Double Angle Quotation Mark#. Collection of scientific papers. Part 1
Imprint Pagination
463 p.
Journal Page Range
p. 416-417

Conference

Title
International Conference on Laser, Plasma Research and Technologies
Original Conference Title
VI Mezhdunarodnaya konferentsiya «Lazernye, plazmennye issledovaniya i tekhnologii – LaPlaz-2020»
Acronym
LaPlas 2020
Dates
11-14 Feb 2020
Place
Moscow (Russian Federation)

INIS

Country of Publication
Russian Federation
Country of Input or Organization
Russian Federation
INIS RN
53056683
Subject category
S42: ENGINEERING;
Resource subtype / Literary indicator
Conference, Numerical Data
Descriptors DEI
COMPRESSION; COMPUTERIZED SIMULATION; METHANE; MOLECULAR DYNAMICS METHOD; PRESSURE RANGE GIGA PA; SHOCK WAVES; THEORETICAL DATA
Descriptors DEC
ALKANES; CALCULATION METHODS; DATA; HYDROCARBONS; INFORMATION; NUMERICAL DATA; ORGANIC COMPOUNDS; PRESSURE RANGE; SIMULATION

Optional Information

Notes
5 refs., 1 tab. Imprint:VI Mezhdunarodnaya konferentsiya #Left-Pointing Double Angle Quotation Mark#Lazernye, plazmennye issledovaniya i tekhnologii #En Dash# LaPlaz-2020#Right-Pointing Double Angle Quotation Mark#. Sbornik nauchnykh trudov. Chast' 1