Skip to search form
Skip to main content
Skip to account menu
Semantic Scholar
Semantic Scholar's Logo
Search 237,198,326 papers from all fields of science
Search
Sign In
Create Free Account
Molecular dynamics
Known as:
Dynamics
, MD
, Atomistics
Expand
Molecular dynamics (MD) is a computer simulation method for studying the physical movements of atoms and molecules, and is thus a type of N-body…
Expand
Wikipedia
(opens in a new tab)
Create Alert
Alert
Related topics
Related topics
50 relations
Analysis of algorithms
Andersen thermostat
Application-specific integrated circuit
Berendsen thermostat
Expand
Broader (1)
Computational chemistry
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
Highly Cited
2003
Highly Cited
2003
Observation of light polarization-dependent structural changes in chalcogenide glasses
Gang Chen
,
H. Jain
,
+4 authors
S. Elliott
2003
Corpus ID: 18982904
The atomistic origin of photoinduced vector (polarization-dependent) phenomena in As–Se films is determined by extended x-ray…
Expand
2003
2003
Structural dynamics of hydrogen bonded methanol oligomers: Vibrational transient hole burning studies of spectral diffusion
I. Piletic
,
K. Gaffney
,
M. Fayer
2003
Corpus ID: 54909393
Frequency resolved pump-probe experiments have been conducted on the deuterated hydroxyl stretch of methanol-d in a solution…
Expand
Highly Cited
2001
Highly Cited
2001
© Copyright Hewlett-Packard Company 2001MODELING PATH DIVERSITY FOR MULTIPLE DESCRIPTION VIDEO COMMUNICATION
2001
Corpus ID: 7273523
Highly Cited
1999
Highly Cited
1999
Self-Assembly of Reverse Micelles in Water/Surfactant/Carbon Dioxide Systems by Molecular Simulation
S. Salaniwal
,
Shengting Cui
,
P. Cummings
,
H. D. Cochran
1999
Corpus ID: 59362477
One of the primary reasons that supercritical carbon dioxide has thus far failed to achieve its full potential as an…
Expand
1999
1999
Modeling of the effects of dose, dose rate, and implant temperature on transient enhanced diffusion
L. Pelaz
,
G. Gilmer
,
V. Venezia
,
H. Gossmann
,
M. Jaraíz
,
J. Barbolla
1999
Corpus ID: 73704915
Atomistic simulations are used to study the effects of implant parameters on transient enhanced diffusion (TED). We analyze 10…
Expand
1997
1997
In situ monitoring of the surface reconstructions on InP(001) prepared by molecular beam epitaxy
K. Ozanyan
,
P. Parbrook
,
M. Hopkinson
,
C. Whitehouse
,
Z. Sobiesierski
,
D. Westwood
1997
Corpus ID: 122325424
Reflection anisotropy spectroscopy (RAS) and reflection high-energy electron diffraction (RHEED) were applied to study clean InP…
Expand
1995
1995
Effects of hydrostatic pressure on dopant diffusion in silicon
Heemyong Park
,
K. S. Jones
,
J. Slinkman
,
M. Law
1995
Corpus ID: 8783807
A point‐defect‐based model for the stress effects on dopant diffusion in silicon is presented. Variations in binding energies and…
Expand
Highly Cited
1994
Highly Cited
1994
Spectroscopic determination of the intermolecular potential energy surface for Ar–NH3
C. Schmuttenmaer
,
R. C. Cohen
,
R. Saykally
1994
Corpus ID: 11017296
The three‐dimensional intermolecular potential energy surface (IPS) for Ar–NH3 has been determined from a least‐squares fit to 61…
Expand
Highly Cited
1992
Highly Cited
1992
Three‐dimensional velocity analysis combining ion imaging with Doppler spectroscopy: Application to photodissociation of HBr at 243 nm
T. Kinugawa
,
T. Arikawa
1992
Corpus ID: 93539123
A simple and sensitive method combining ion imaging with Doppler spectroscopy has been developed to measure full three…
Expand
1987
1987
Proton Nuclear Magnetic Resonance Study of Hirudin: Resonance Assignment and Secondary Structure?
D. Sukumaran
,
G. Clore
,
A. Preuss
,
J. Zarbock
,
A. Gronenborn
1987
Corpus ID: 51269576
The /sup 1/H NMR spectrum of the 65-residue protein hirudin is assigned in a sequential manner by using a combination of two…
Expand