
MOLPRO
 Referenced in 22 articles
[sw06125]
 computations, with extensive treatment of the electron correlation problem through the multiconfigurationreference CI, coupled ... associated methods. The recently developed explicitly correlated coupledcluster methods yield CCSD(T) results with ... orders of magnitude. Using local electron correlation methods, which significantly reduce the increase...

REOS99
 Referenced in 4 articles
[sw00799]
 must include the effects of relativity, electron correlations, and the rearrangement of the electron density...

ALPSCore
 Referenced in 3 articles
[sw28323]
 systems, in particular systems with strongly correlated electrons. They consist of a set of components...

iQIST
 Referenced in 2 articles
[sw16777]
 applications in theoretical studies of strongly correlated electron systems. Especially, they play a key role ... dynamical meanfield theory calculations of correlated lattice models and realistic materials. Therefore, the development...

cthyb
 Referenced in 2 articles
[sw17809]
 role in the description of strongly correlated electron materials, where the complicated manybody problem...

TRIQS
 Referenced in 2 articles
[sw19502]
 quantum physics, and in particular, stronglycorrelated electronic systems. It supplies components to develop codes...

mcci
 Referenced in 1 article
[sw12215]
 generation computer program for the calculation of electronic states of atoms, molecules, and quantum dots ... considered molecules with up to 20 correlated electrons. With reasonable sized basis set expansions ... cent of the correlation energy has been obtained for small molecular systems. In principle, there ... solids is currently being investigated, and the electronic states for simplified models of quantum dots...

CPMCLab
 Referenced in 1 article
[sw19934]
 calculations in many other models for correlated electron systems, and can serve as a template...

fhi98PP
 Referenced in 10 articles
[sw17871]
 initio pseudopotentials for electronic structure calculations of polyatomic systems using densityfunctional theory ... generalized gradient approximation for exchange and correlation are implemented...

RDFTools
 Referenced in 2 articles
[sw30881]
 distribution functions and other pair correlation functions from electron diffraction patterns of disordered solids...

RegulonDB
 Referenced in 51 articles
[sw25948]
 Escherichia coli K12, currently the bestknown electronically encoded database of the genetic regulatory network ... data can be accessed through overviews of correlations about gene regulation. RegulonDB associated original literature...

CheMPS2
 Referenced in 4 articles
[sw17633]
 strong correlation. In the fields of condensed matter, nuclear structure and molecular electronic structure ... electrons, D 𝖲𝖴(2) =2500)/ccpVDZ level of theory. The contribution of 1s core correlation...

CRYSCOR
 Referenced in 5 articles
[sw20310]
 electronic structure calculations for 1D, 2D and 3Dperiodic nonconducting systems at the correlated ... periodic LCAOcode CRYSTAL. The local correlation scheme is similiar to that applied ... techniques, e.g. in the MOLPRO package. TwoElectron integrals are efficiently calculated using the density...

SHIML
 Referenced in 2 articles
[sw10294]
 perturbed angular correlation spectroscopy (PAC) measure electronic and magnetic structure within Angstroms of nuclear probes...

xc_functional
 Referenced in 1 article
[sw34850]
 parametrization of the exchange correlation free energy of the uniform electron gas at finite temperature ... Bonitz; Ab initio ExchangeCorrelation Free Energy of the Uniform Electron Gas at Warm Dense...

AAPL
 Referenced in 1 article
[sw27882]
 materials characterized by strong electron localization and correlation. Combining AAPL with the pseudohybrid functional...

nextnano
 Referenced in 5 articles
[sw11317]
 predicting and understanding a wide range of electronic and optical properties of semiconductor nanostructures ... correlation effects are taken into account in terms of the local density scheme. The electronic...

WHIZARD
 Referenced in 17 articles
[sw17837]
 processes as decay cascades including complete spin correlations. Different options for QCD parton showers ... CIRCE) and ISR spectra are included for electrons and photons. The events can be written...

RELION
 Referenced in 15 articles
[sw22792]
 macromolecular structures by singleparticle analysis of electron cryomicroscopy (cryoEM) data. Whereas alternative ... called goldstandard Fourier shell correlation (FSC) procedure to prevent overfitting is also described...

CoolProp
 Referenced in 10 articles
[sw27300]
 states method. All of the thermophysical property correlations described here have been implemented into CoolProp ... CoolProp library is included as an electronic annex...