Literature DB >> 10045746

Dielectric tensor, effective charges, and phonons in alpha -quartz by variational density-functional perturbation theory.

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Abstract

Year:  1992        PMID： 10045746     DOI： 10.1103/PhysRevLett.68.3603

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN： 0031-9007            Impact factor:   9.161


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  7 in total

1.  Vibrational properties, phonon spectrum and related thermal parameters of β-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine: a theoretical study.

Authors:  Wen Qian; Weibin Zhang; Hehou Zong; Guofang Gao; Yang Zhou; Chaoyang Zhang
Journal:  J Mol Model       Date:  2015-12-15       Impact factor: 1.810

2. 

Authors:  Fatma Saad Saoud; Jean Claude Plenet; Mohamed Henini
Journal:  Physica B Condens Matter       Date:  2012-03-15       Impact factor: 2.436

3.  Hidden electronic rule in the "cluster-plus-glue-atom" model.

Authors:  Jinglian Du; Chuang Dong; Roderick Melnik; Yoshiyuki Kawazoe; Bin Wen
Journal:  Sci Rep       Date:  2016-09-19       Impact factor: 4.379

4.  Lattice Dynamics Study of Phonon Instability and Thermal Properties of Type-I Clathrate K₈Si46 under High Pressure.

Authors:  Wei Zhang; Zhao Yi Zeng; Ni Na Ge; Zhi Guo Li
Journal:  Materials (Basel)       Date:  2016-07-25       Impact factor: 3.623

5.  Lattice dynamics, mechanical stability and electronic structure of Fe-based Heusler semiconductors.

Authors:  Shakeel Ahmad Khandy; Ishtihadah Islam; Dinesh C Gupta; Rabah Khenata; A Laref
Journal:  Sci Rep       Date:  2019-02-06       Impact factor: 4.379

6.  Constrained Density Functional Theory: A Potential-Based Self-Consistency Approach.

Authors:  Xavier Gonze; Benjamin Seddon; James A Elliott; Christian Tantardini; Alexander V Shapeev
Journal:  J Chem Theory Comput       Date:  2022-09-13       Impact factor: 6.578

Review 7.  Hydroxylapatite and Related Minerals in Bone and Dental Tissues: Structural, Spectroscopic and Mechanical Properties from a Computational Perspective.

Authors:  Gianfranco Ulian; Daniele Moro; Giovanni Valdrè
Journal:  Biomolecules       Date:  2021-05-13
  7 in total

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