Bibliography
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Bibliography
1. Bader JS, Berne BJ (1994) Quantum and classical relaxation rates from classical simulations.
J Chem Phys 100:8359–8366
2. Bertie JE, Zhang SL, Eysel HH, Baluja S, Ahmed MK (1993) Infrared intensities of liquids
XI: infrared refractive indices from 8000 to 2 cm −1 , absolute integrated intensities, and dipole
moment derivatives of methanol at 25 ◦ C. Appl Spectrosc 47:1100–1144
3. Buck M, Himmelhaus M (2001) Vibrational spectroscopy of interfaces by infrared-visible sum
frequency generation. J Vac Sci Technol A 19:2717–2736
4. Falk M, Whalley E (1961) Infreared spectra of methanol and deuterated methanols in gas,
liquid, and solid phases. J Chem Phys 34:1554–1568
5. Gan W, Wu B-H, Chen H, Guo Y, Wang H-F (2005) Accuracy and sensitivity of determining
molecular orientation at interfaces using sum frequency generation vibrational spectroscopy.
Chem Phys Lett 406:467–473
6. Gan W, Zhang Z, Feng R-R, Wang H-F (2006) Identification of overlapping features in the sum
frequency generation vibrational spectra of air/ethanol interface. Chem Phys Lett 423:261–265
7. Gan W, Wu B-H, Zhang Z, Guo Y, Wang H-F (2007) Vibrational spectra and molecular
orientation with experimental configuration analysis in surface sum frequency generation
(SFG). J Phys Chem C 111:8716–8725
8. Gan W, Zhang Z, Feng R-R, Wang H-F (2007) Spectral interference and molecular
conformation at liquid interface with sum frequency generation vibrational spectroscopy (SFGVS). J Phys Chem C 111:8726–8738
9. Groenzin H, Li I, Shultz MJ (2008) Sum-frequency generation: polarization surface spectroscopy analysis of the vibrational surface modes on the basal face of ice Ih. J Chem Phys
128:214510
10. Heinz TF, Tom HWK, Shen YR (1983) Determination of molecular orientation of monolayer
adsorbates by optical second-harmonic generation. Phys Rev A 28:1883–1885
11. Hirose C, Akamatsu A, Domen K (1992) Formulas for the analysis of surface sum-frequency
generation spectrum by CH stretching modes of methyl and methylene groups. J Chem Phys
96:997–1004
12. Hirose C, Hiroyoshi Y, Akamatsu N, Domen K (1993) Orientation analysis by simulation of
vibrational sum frequency generation spectrum: CH stretching bands of the methyl group. J
Phys Chem 97:10064–10069
13. Hommel EL, Allen HC (2003) The air-liquid interface of benzene, toluene, m-xylene, and
mesitylene: a sum frequency, Raman, and infrared spectroscopic study. Analyst 128:750–755
14. Hunt JH, Guyot-Sionnest P, Shen YR (1987) Observation of C–H stretch vibrations of
monolayers of molecules optical sum-frequency generation. Chem Phys Lett 133:189–192
15. Ishihara T, Ishiyama T, Morita A (2015) Surface structure of methanol/water solutions via
sum-frequency orientational analysis and molecular dynamics simulation. J Phys Chem C
119:9879–9889
16. Ishiyama T, Sokolov VV, Morita A (2011) Molecular dynamics simulation of liquid
methanol. I. Molecular modeling including C–H vibration and Fermi resonance. J Chem Phys
134:024509
17. Ishiyama T, Sokolov VV, Morita A (2011) Molecular dynamics simulation of liquid methanol.
II. Unified assignment of Infrared, Raman, and sum frequency generation vibrational spectra
in methyl C–H stretching region. J Chem Phys 134:024510
18. Kawaguchi T, Shiratori K, Henmi Y, Ishiyama T, Morita A (2012) Mechanisms of sum frequency generation from liquid benzene: symmetry breaking at interface and bulk contribution.
J Phys Chem C 116:13169–13182
19. Kim J, Chou KC, Somorjai GA (2003) Structure and dynamics of acetonitrile at the air/liquid
interface of binary solutions studied by infrared-visible sum frequency generation. J Phys
Chem B 107:1592–1596
259
Bibliography
1. Bader JS, Berne BJ (1994) Quantum and classical relaxation rates from classical simulations.
J Chem Phys 100:8359–8366
2. Bertie JE, Zhang SL, Eysel HH, Baluja S, Ahmed MK (1993) Infrared intensities of liquids
XI: infrared refractive indices from 8000 to 2 cm −1 , absolute integrated intensities, and dipole
moment derivatives of methanol at 25 ◦ C. Appl Spectrosc 47:1100–1144
3. Buck M, Himmelhaus M (2001) Vibrational spectroscopy of interfaces by infrared-visible sum
frequency generation. J Vac Sci Technol A 19:2717–2736
4. Falk M, Whalley E (1961) Infreared spectra of methanol and deuterated methanols in gas,
liquid, and solid phases. J Chem Phys 34:1554–1568
5. Gan W, Wu B-H, Chen H, Guo Y, Wang H-F (2005) Accuracy and sensitivity of determining
molecular orientation at interfaces using sum frequency generation vibrational spectroscopy.
Chem Phys Lett 406:467–473
6. Gan W, Zhang Z, Feng R-R, Wang H-F (2006) Identification of overlapping features in the sum
frequency generation vibrational spectra of air/ethanol interface. Chem Phys Lett 423:261–265
7. Gan W, Wu B-H, Zhang Z, Guo Y, Wang H-F (2007) Vibrational spectra and molecular
orientation with experimental configuration analysis in surface sum frequency generation
(SFG). J Phys Chem C 111:8716–8725
8. Gan W, Zhang Z, Feng R-R, Wang H-F (2007) Spectral interference and molecular
conformation at liquid interface with sum frequency generation vibrational spectroscopy (SFGVS). J Phys Chem C 111:8726–8738
9. Groenzin H, Li I, Shultz MJ (2008) Sum-frequency generation: polarization surface spectroscopy analysis of the vibrational surface modes on the basal face of ice Ih. J Chem Phys
128:214510
10. Heinz TF, Tom HWK, Shen YR (1983) Determination of molecular orientation of monolayer
adsorbates by optical second-harmonic generation. Phys Rev A 28:1883–1885
11. Hirose C, Akamatsu A, Domen K (1992) Formulas for the analysis of surface sum-frequency
generation spectrum by CH stretching modes of methyl and methylene groups. J Chem Phys
96:997–1004
12. Hirose C, Hiroyoshi Y, Akamatsu N, Domen K (1993) Orientation analysis by simulation of
vibrational sum frequency generation spectrum: CH stretching bands of the methyl group. J
Phys Chem 97:10064–10069
13. Hommel EL, Allen HC (2003) The air-liquid interface of benzene, toluene, m-xylene, and
mesitylene: a sum frequency, Raman, and infrared spectroscopic study. Analyst 128:750–755
14. Hunt JH, Guyot-Sionnest P, Shen YR (1987) Observation of C–H stretch vibrations of
monolayers of molecules optical sum-frequency generation. Chem Phys Lett 133:189–192
15. Ishihara T, Ishiyama T, Morita A (2015) Surface structure of methanol/water solutions via
sum-frequency orientational analysis and molecular dynamics simulation. J Phys Chem C
119:9879–9889
16. Ishiyama T, Sokolov VV, Morita A (2011) Molecular dynamics simulation of liquid
methanol. I. Molecular modeling including C–H vibration and Fermi resonance. J Chem Phys
134:024509
17. Ishiyama T, Sokolov VV, Morita A (2011) Molecular dynamics simulation of liquid methanol.
II. Unified assignment of Infrared, Raman, and sum frequency generation vibrational spectra
in methyl C–H stretching region. J Chem Phys 134:024510
18. Kawaguchi T, Shiratori K, Henmi Y, Ishiyama T, Morita A (2012) Mechanisms of sum frequency generation from liquid benzene: symmetry breaking at interface and bulk contribution.
J Phys Chem C 116:13169–13182
19. Kim J, Chou KC, Somorjai GA (2003) Structure and dynamics of acetonitrile at the air/liquid
interface of binary solutions studied by infrared-visible sum frequency generation. J Phys
Chem B 107:1592–1596