The Dalton2011 suite consists of two separate executables, DALTON and LSDALTON. The DALTON code is a powerful tool for a wide range of molecular properties at different levels of theory, whereas LSDALTON is a linear-scaling HF and DFT code suitable for large molecular systems. Any published work arising from use of one of the Dalton2011 programs must acknowledge that program by a proper reference. The following list of capabilities of the Dalton2011 programs should give you some indication of whether or not the Dalton2011 suite is able to meet your requirements.

DALTON2011 Program

ANGELI, Celestino;CIMIRAGLIA, Renzo;
2011

Abstract

The Dalton2011 suite consists of two separate executables, DALTON and LSDALTON. The DALTON code is a powerful tool for a wide range of molecular properties at different levels of theory, whereas LSDALTON is a linear-scaling HF and DFT code suitable for large molecular systems. Any published work arising from use of one of the Dalton2011 programs must acknowledge that program by a proper reference. The following list of capabilities of the Dalton2011 programs should give you some indication of whether or not the Dalton2011 suite is able to meet your requirements.
2011
File in questo prodotto:
Non ci sono file associati a questo prodotto.

I documenti in SFERA sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.

Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11392/1735498
 Attenzione

Attenzione! I dati visualizzati non sono stati sottoposti a validazione da parte dell'ateneo

Citazioni
  • ???jsp.display-item.citation.pmc??? ND
  • Scopus ND
  • ???jsp.display-item.citation.isi??? ND
social impact