Skip to search formSkip to main contentSkip to account menu

Pseudopotential

Known as: Fermi pseudopotential, ECP, Effective Core Potential 
In physics, a pseudopotential or effective potential is used as an approximation for the simplified description of complex systems. Applications… 
Wikipedia (opens in a new tab)

Related topics

Related topics

20 relations
ABINITBasis set (chemistry)BigDFTCar–Parrinello molecular dynamics

Broader (1)

Computational physics

Papers overview

Semantic Scholar uses AI to extract papers important to this topic.
Highly Cited
2006
Highly Cited
2006
Trapping of 27 bp–8 kbp DNA and immobilization of thiol-modified DNA using dielectrophoresis
Dielectrophoretic trapping of six different DNA fragments, sizes varying from 27 to 8416 bp, has been studied using confocal… 
Highly Cited
2006
Highly Cited
2006
DFT modeling and spectroscopic study of metal-ligand bonding in La(III) complex of coumarin-3-carboxylic acid
Highly Cited
2003
Highly Cited
2003
Six low-strain zinc-blende half metals: An ab initio investigation
these findings, we further propose substrates on which the growth may be accomplished with minimum strain. Our findings are… 
Highly Cited
2001
Highly Cited
2001
Density-functional study of the adsorption of benzene on the (1 1 1), (1 0 0) and (1 1 0) surfaces of nickel
Highly Cited
2000
Highly Cited
2000
Interaction of neutral and zwitterionic glycine with Zn2+ in gas phase: ab initio and SIBFA molecular mechanics calculations
The interaction of Zn2+ with glycine (Gly) in the gas phase is studied by a combination of ab initio and molecular mechanics… 
2000
2000
Structure, optical absorption, and luminescence energy calculations of Ce3+ defects in LiBaF3
!5d transitions in these different geometries. Comparison of these energies with the results of opticalabsorption measurements on… 
Highly Cited
1999
Highly Cited
1999
Raman spectroscopy on single- and multi-walled nanotubes under high pressure
Abstract.The pressure dependence of the high-energy Raman modes in single- and multi-walled carbon nanotubes was measured in the… 
Highly Cited
1999
Highly Cited
1999
Streamline-oriented grid generation for transport modelling in two-dimensional domains including wells
Highly Cited
1998
Highly Cited
1998
Energetics and vibrational frequencies of interstitial H2 molecules in semiconductors
Highly Cited
1985
Highly Cited
1985
Assessment of errors involved in the determination of interproton distance ratios and distances by means of one- and two-dimensional NOE measurements
By clicking accept or continuing to use the site, you agree to the terms outlined in our Privacy Policy (opens in a new tab), Terms of Service (opens in a new tab), and Dataset License (opens in a new tab)