FT-IR, XPS and Density Functional Theory Study of Adsorption Mechanism of Sodium Formate onto Goethite or Hematite

Light Metals 2016 ◽

10.1007/978-3-319-48251-4_6 ◽

2016 ◽

pp. 29-35

Author(s):

Meng Wang ◽

Huiping Hu ◽

Qiyuan Chen ◽

Guangfu Ji

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Adsorption Mechanism ◽

Sodium Formate ◽

Density Functional Theory Study ◽

Functional Theory ◽

Ft Ir

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Ft- Ir, XPS and Density Functional Theory Study of Adsorption Mechanism of Sodium Formate onto Goethite or Hematite

Light Metals 2016 ◽

10.1002/9781119274780.ch6 ◽

2016 ◽

pp. 29-35

Author(s):

Meng Wang ◽

Huiping Hu ◽

Qiyuan Chen ◽

Guangfu Ji

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Adsorption Mechanism ◽

Sodium Formate ◽

Density Functional Theory Study ◽

Functional Theory ◽

Ft Ir

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Adsorption mechanism of H2S and CH3SH on Fe(110) surface: A density functional theory study

Physica E Low-dimensional Systems and Nanostructures ◽

10.1016/j.physe.2021.114938 ◽

2022 ◽

Vol 135 ◽

pp. 114938

Author(s):

Meng Hao ◽

Wen Zeng ◽

Yanqiong Li

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Adsorption Mechanism ◽

Density Functional Theory Study ◽

Functional Theory

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FT-Raman, FT-IR and normal-mode analysis of carcinogenic polycyclic aromatic hydrocarbons. Part I?a density functional theory study of benzo(a)pyrene (BaP) and benzo(e)pyrene (BeP)

Journal of Raman Spectroscopy ◽

10.1002/1097-4555(200101)32:1<45::aid-jrs666>3.0.co;2-9 ◽

2001 ◽

Vol 32 (1) ◽

pp. 45-51 ◽

Cited By ~ 12

Author(s):

H.-P. Chiang ◽

B. Mou ◽

K. P. Li ◽

P. Chiang ◽

D. Wang ◽

...

Keyword(s):

Density Functional Theory ◽

Aromatic Hydrocarbons ◽

Density Functional ◽

Normal Mode Analysis ◽

Mode Analysis ◽

Density Functional Theory Study ◽

Functional Theory ◽

Polycyclic Aromatic ◽

Ft Ir ◽

Ft Raman

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Density functional theory study, FT-IR and FT-Raman spectra and SQM force field calculation for vibrational analysis of 1, 3-Bis (hydroxymethyl) benzimidazolin-2-one

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2013.05.003 ◽

2013 ◽

Vol 114 ◽

pp. 432-440

Author(s):

Lynnette Joseph ◽

D. Sajan ◽

K. Chaitanya ◽

H.C. Devarajegowda ◽

Jayakumary Isac

Keyword(s):

Density Functional Theory ◽

Force Field ◽

Density Functional ◽

Vibrational Analysis ◽

Field Calculation ◽

Density Functional Theory Study ◽

Functional Theory ◽

Force Field Calculation ◽

Ft Ir ◽

Ft Raman

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Density functional theory study of the FT-IR spectra of phthalimide and N-bromophthalimide

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2005.02.051 ◽

2005 ◽

Vol 62 (4-5) ◽

pp. 918-925 ◽

Cited By ~ 114

Author(s):

V. Krishnakumar ◽

V. Balachandran ◽

T. Chithambarathanu

Keyword(s):

Density Functional Theory ◽

Ir Spectra ◽

Density Functional ◽

Density Functional Theory Study ◽

Functional Theory ◽

Ft Ir

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Density functional theory study on the enhanced adsorption mechanism of gaseous pollutants on Al-doped Ti2CO2 monolayer

Sustainable Materials and Technologies ◽

10.1016/j.susmat.2021.e00294 ◽

2021 ◽

pp. e00294

Author(s):

Zechao Wu ◽

Junhui Zhou ◽

Didi Li ◽

Zhimin Ao ◽

Taicheng An ◽

...

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Adsorption Mechanism ◽

Gaseous Pollutants ◽

Density Functional Theory Study ◽

Functional Theory ◽

Enhanced Adsorption

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Adsorption mechanism of sulphide gas molecules on γ-Fe(1 1 1) surface: A density functional theory study

Applied Surface Science ◽

10.1016/j.apsusc.2021.150376 ◽

2021 ◽

pp. 150376

Author(s):

Meng Hao ◽

Wen Zeng

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Adsorption Mechanism ◽

Density Functional Theory Study ◽

Functional Theory ◽

Gas Molecules

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Density functional theory study and vibrational analysis of FT-IR and FT-Raman spectra of N-hydroxyphthalimide

Journal of Raman Spectroscopy ◽

10.1002/jrs.2214 ◽

2009 ◽

Vol 40 (8) ◽

pp. 987-991 ◽

Cited By ~ 19

Author(s):

V. Krishnakumar ◽

M. Sivasubramanian ◽

S. Muthunatesan

Keyword(s):

Density Functional Theory ◽

Raman Spectra ◽

Density Functional ◽

Vibrational Analysis ◽

Density Functional Theory Study ◽

Functional Theory ◽

Ft Ir ◽

Ft Raman

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Two-Dimensional Infrared Correlation Spectroscopy, Conductor-like Screening Model for Real Solvents, and Density Functional Theory Study on the Adsorption Mechanism of Polyvinylpolypyrrolidone for Effective Phenol Removal in an Aqueous Medium

ACS Omega ◽

10.1021/acsomega.1c02699 ◽

2021 ◽

Vol 6 (39) ◽

pp. 25179-25192

Author(s):

Muhammad Ammar Mohammad Alwi ◽

Erna Normaya ◽

Hakimah Ismail ◽

Anwar Iqbal ◽

Bijarimi Mat Piah ◽

...

Keyword(s):

Density Functional Theory ◽

Aqueous Medium ◽

Density Functional ◽

Adsorption Mechanism ◽

Correlation Spectroscopy ◽

Phenol Removal ◽

Two Dimensional ◽

Density Functional Theory Study ◽

Functional Theory ◽

Screening Model

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Adsorption mechanism of NH3, NO, and O2 molecules over MnxOy/Ni (111) surface: a density functional theory study

Journal of Materials Science ◽

10.1007/s10853-019-03929-3 ◽

2019 ◽

Vol 54 (23) ◽

pp. 14414-14430 ◽

Cited By ~ 1

Author(s):

Qilong Fang ◽

Baozhong Zhu ◽

Yunlan Sun ◽

Weiyi Song ◽

Chaoyue Xie ◽

...

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Adsorption Mechanism ◽

Density Functional Theory Study ◽

Functional Theory

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FT-IR, XPS and Density Functional Theory Study of Adsorption Mechanism of Sodium Formate onto Goethite or Hematite

Ft- Ir, XPS and Density Functional Theory Study of Adsorption Mechanism of Sodium Formate onto Goethite or Hematite

Adsorption mechanism of H2S and CH3SH on Fe(110) surface: A density functional theory study

FT-Raman, FT-IR and normal-mode analysis of carcinogenic polycyclic aromatic hydrocarbons. Part I?a density functional theory study of benzo(a)pyrene (BaP) and benzo(e)pyrene (BeP)

Density functional theory study, FT-IR and FT-Raman spectra and SQM force field calculation for vibrational analysis of 1, 3-Bis (hydroxymethyl) benzimidazolin-2-one

Density functional theory study of the FT-IR spectra of phthalimide and N-bromophthalimide

Density functional theory study on the enhanced adsorption mechanism of gaseous pollutants on Al-doped Ti2CO2 monolayer

Adsorption mechanism of sulphide gas molecules on γ-Fe(1 1 1) surface: A density functional theory study

Density functional theory study and vibrational analysis of FT-IR and FT-Raman spectra of N-hydroxyphthalimide

Two-Dimensional Infrared Correlation Spectroscopy, Conductor-like Screening Model for Real Solvents, and Density Functional Theory Study on the Adsorption Mechanism of Polyvinylpolypyrrolidone for Effective Phenol Removal in an Aqueous Medium

Adsorption mechanism of NH3, NO, and O2 molecules over MnxOy/Ni (111) surface: a density functional theory study

Adsorption mechanism of sulphide gas molecules on γ-Fe(1 1 1) surface: A density functional theory study