Literature DB >> 9984457

Infrared intensities and Raman-scattering activities within density-functional theory.

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Abstract

Year:  1996        PMID: 9984457     DOI: 10.1103/physrevb.54.7830

Source DB:  PubMed          Journal:  Phys Rev B Condens Matter        ISSN: 0163-1829


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  25 in total

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2.  Evaluation of molecular photophysical and photochemical properties using linear response time-dependent density functional theory with classical embedding: Successes and challenges.

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4.  The structure and vibrational spectroscopy of cryolite, Na3AlF6.

Authors:  Stewart F Parker; Anibal J Ramirez-Cuesta; Luke L Daemen
Journal:  RSC Adv       Date:  2020-07-08       Impact factor: 4.036

5.  Lattice Dynamics of the Rhenium and Technetium Dichalcogenides.

Authors:  Daniel Wolverson; Lewis S Hart
Journal:  Nanoscale Res Lett       Date:  2016-05-13       Impact factor: 4.703

6.  Edge phonons in black phosphorus.

Authors:  H B Ribeiro; C E P Villegas; D A Bahamon; D Muraca; A H Castro Neto; E A T de Souza; A R Rocha; M A Pimenta; C J S de Matos
Journal:  Nat Commun       Date:  2016-07-14       Impact factor: 14.919

7.  Precise determination of graphene functionalization by in situ Raman spectroscopy.

Authors:  Philipp Vecera; Julio C Chacón-Torres; Thomas Pichler; Stephanie Reich; Himadri R Soni; Andreas Görling; Konstantin Edelthalhammer; Herwig Peterlik; Frank Hauke; Andreas Hirsch
Journal:  Nat Commun       Date:  2017-05-08       Impact factor: 14.919

8.  Stable magnesium peroxide at high pressure.

Authors:  Sergey S Lobanov; Qiang Zhu; Nicholas Holtgrewe; Clemens Prescher; Vitali B Prakapenka; Artem R Oganov; Alexander F Goncharov
Journal:  Sci Rep       Date:  2015-09-01       Impact factor: 4.379

9.  Nitrogen oxides under pressure: stability, ionization, polymerization, and superconductivity.

Authors:  Dongxu Li; Artem R Oganov; Xiao Dong; Xiang-Feng Zhou; Qiang Zhu; Guangrui Qian; Huafeng Dong
Journal:  Sci Rep       Date:  2015-11-17       Impact factor: 4.379

10.  Few-Layer Antimonene by Liquid-Phase Exfoliation.

Authors:  Carlos Gibaja; David Rodriguez-San-Miguel; Pablo Ares; Julio Gómez-Herrero; Maria Varela; Roland Gillen; Janina Maultzsch; Frank Hauke; Andreas Hirsch; Gonzalo Abellán; Félix Zamora
Journal:  Angew Chem Int Ed Engl       Date:  2016-08-16       Impact factor: 15.336

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