Research output: Contribution to journal › Article › peer-review
Raman Spectra of Crystalline Nanoparticles : Replacement for the Phonon Confinement Model. / Коняхин, Сергей; Утесов, Олег; Тертеров, Иван; Сиклицкая, Александра ; Яшенкин, Андрей Геннадьевич; Солнышков, Дмитрий .
In: Journal of Physical Chemistry C, Vol. 122, No. 33, 23.08.2018, p. 19219-19229.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Raman Spectra of Crystalline Nanoparticles
T2 - Replacement for the Phonon Confinement Model
AU - Коняхин, Сергей
AU - Утесов, Олег
AU - Тертеров, Иван
AU - Сиклицкая, Александра
AU - Яшенкин, Андрей Геннадьевич
AU - Солнышков, Дмитрий
PY - 2018/8/23
Y1 - 2018/8/23
N2 - In crystalline nanoparticles, the Raman peak is downshifted with respect to the bulk material and has asymmetric broadening. These effects are straightly related to the finite size of nanoparticles, giving the perspective to use Raman spectroscopy as the size probe. By combining the dynamical matrix method (DMM) and the bond polarization model (BPM), we develop a new (DMM-BPM) approach for the description of Raman spectra of nanoparticle powders. The numerical variant of this approach is suitable for the description of small particles, whereas its analytical version is simpler to implement and allows one to obtain the Raman spectra of arbitrary-sized particles. Focusing on nanodiamond powders, the DMM BPM theory is shown to fit the most recent experimental data much better than the commonly used phonon confinement model.
AB - In crystalline nanoparticles, the Raman peak is downshifted with respect to the bulk material and has asymmetric broadening. These effects are straightly related to the finite size of nanoparticles, giving the perspective to use Raman spectroscopy as the size probe. By combining the dynamical matrix method (DMM) and the bond polarization model (BPM), we develop a new (DMM-BPM) approach for the description of Raman spectra of nanoparticle powders. The numerical variant of this approach is suitable for the description of small particles, whereas its analytical version is simpler to implement and allows one to obtain the Raman spectra of arbitrary-sized particles. Focusing on nanodiamond powders, the DMM BPM theory is shown to fit the most recent experimental data much better than the commonly used phonon confinement model.
KW - BOND POLARIZABILITY MODEL
KW - TEMPERATURE-DEPENDENCE
KW - LIGHT-SCATTERING
KW - OPTICAL PHONON
KW - DIAMOND
KW - SPECTROSCOPY
KW - NANODIAMOND
KW - SILICON
KW - SIZE
KW - DISPERSION
U2 - 10.1021/acs.jpcc.8b05415
DO - 10.1021/acs.jpcc.8b05415
M3 - статья
VL - 122
SP - 19219
EP - 19229
JO - Journal of Physical Chemistry C
JF - Journal of Physical Chemistry C
SN - 1932-7447
IS - 33
ER -
ID: 36592632