Density functional theory studies on the electronic, structural, phonon dynamical and thermo-stability properties of bicarbonates MHCO3, M = Li, Na, K

Yuhua Duan; Bo Zhang; Dan C Sorescu; J Karl Johnson; Eric H Majzoub; David R Luebke

doi:10.1088/0953-8984/24/32/325501

Density functional theory studies on the electronic, structural, phonon dynamical and thermo-stability properties of bicarbonates MHCO3, M = Li, Na, K

Yuhua Duan
, Bo Zhang
, Dan C Sorescu
, J Karl Johnson
, Eric H Majzoub
, David R Luebke

University of Missouri-St. Louis

Research output: Contribution to journal › Article › peer-review

Original language	American English
Journal	Journal of Physics: Condensed Matter
Volume	24
DOIs	https://doi.org/10.1088/0953-8984/24/32/325501
State	Published - Aug 15 2012

Disciplines

Analytical Chemistry
Condensed Matter Physics

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10.1088/0953-8984/24/32/325501License: Unspecified

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title = "Density functional theory studies on the electronic, structural, phonon dynamical and thermo-stability properties of bicarbonates MHCO3, M = Li, Na, K",

author = "Yuhua Duan and Bo Zhang and Sorescu, \{Dan C\} and Johnson, \{J Karl\} and Majzoub, \{Eric H\} and Luebke, \{David R\}",

year = "2012",

month = aug,

day = "15",

doi = "10.1088/0953-8984/24/32/325501",

language = "American English",

volume = "24",

journal = "Journal of Physics: Condensed Matter",

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TY - JOUR

T1 - Density functional theory studies on the electronic, structural, phonon dynamical and thermo-stability properties of bicarbonates MHCO3, M = Li, Na, K

AU - Duan, Yuhua

AU - Zhang, Bo

AU - Sorescu, Dan C

AU - Johnson, J Karl

AU - Majzoub, Eric H

AU - Luebke, David R

PY - 2012/8/15

Y1 - 2012/8/15

UR - http://iopscience.iop.org/article/10.1088/0953-8984/24/32/325501/pdf

U2 - 10.1088/0953-8984/24/32/325501

DO - 10.1088/0953-8984/24/32/325501

M3 - Article

VL - 24

JO - Journal of Physics: Condensed Matter

JF - Journal of Physics: Condensed Matter

ER -

Density functional theory studies on the electronic, structural, phonon dynamical and thermo-stability properties of bicarbonates MHCO3, M = Li, Na, K

Disciplines

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