(Q58685599)

English

An improved method for density functional calculations of the frequency-dependent optical rotation

No description defined

In more languages

edit

Statements

instance of

scholarly article

0 references

title

An improved method for density functional calculations of the frequency-dependent optical rotation (English)

0 references

3

Reinhart Ahlrichs

0 references

author name string

Stefan Grimme

series ordinal

1

0 references

publication date

July 2002

0 references

published in

Chemical Physics Letters

0 references

volume

361

0 references

issue

3-4

0 references

page(s)

321-328

0 references

cites work

Circular Dichroism of Helicenes Investigated by Time-Dependent Density Functional Theory

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Density-functional thermochemistry. III. The role of exact exchange

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

On the density matrix based approach to time-dependent density functional response theory

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Vibrational Raman optical activity calculations using London atomic orbitals

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Über Elementarakte mit zwei Quantensprüngen

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Electronic structure calculations on workstation computers: The program system turbomole

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Density-functional exchange-energy approximation with correct asymptotic behavior

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Fullerene C80: Are there still more isomers?

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

Electron affinities of the first‐row atoms revisited. Systematic basis sets and wave functions

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1016%2FS0009-2614%2802%2900975-2

retrieved

7 January 2021

based on heuristic

inferred from DOI database lookup

Identifiers

DOI

10.1016/S0009-2614(02)00975-2

0 references

(Q58685599)

An improved method for density functional calculations of the frequency-dependent optical rotation

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)