화학공학소재연구정보센터
검색결과 : 20건
No. Article
1 Overtones of nu C N Vibration as a Probe of Structure of Liquid CH3CN, CD3CN, and CCl3CN: Combined Infrared, Near-Infrared, and Raman Spectroscopic Studies with Anharmonic Density Functional Theory Calculations
Bec KB, Karczmit D, Kwasniewicz M, Ozaki Y, Czarnecki MA
Journal of Physical Chemistry A, 123(20), 4431, 2019
2 IR Spectra of Crystalline Nucleobases: Combination of Periodic Harmonic Calculations with Anharmonic Corrections Based on Finite Models
Bec KB, Grabska J, Czarnecki MA, Huck CW, Wojcik MJ, Nakajima T, Ozaki Y
Journal of Physical Chemistry B, 123(47), 10001, 2019
3 Spectroscopic and Quantum Mechanical Calculation Study of the Effect of Isotopic Substitution on NIR Spectra of Methanol
Grabska J, Czarnecki MA, Bec KB, Ozaki Y
Journal of Physical Chemistry A, 121(41), 7925, 2017
4 Advances in Molecular Structure and Interaction Studies Using Near-Infrared Spectroscopy
Czarnecki MA, Morisawa Y, Futami Y, Ozaki Y
Chemical Reviews, 115(18), 9707, 2015
5 Combined IR/NIR and Density Functional Theory Calculations Analysis of the Solvent Effects on Frequencies and Intensities of the Fundamental and Overtones of the C=O Stretching Vibrations of Acetone and 2-Hexanone
Chen YJ, Morisawa Y, Futami Y, Czarnecki MA, Wang HS, Ozaki Y
Journal of Physical Chemistry A, 118(14), 2576, 2014
6 Rotational isomerism of butanols: Infrared, near-infrared and DFT study
Czarnecki MA, Wojtkow D, Haufa K
Chemical Physics Letters, 431(4-6), 294, 2006
7 Effect of temperature and concentration on the structure of sec-butyl alcohol and isobutyl alcohol/water mixtures: Near-infrared spectroscopic study
Wojtkow D, Czarnecki MA
Journal of Physical Chemistry A, 110(36), 10552, 2006
8 Effect of temperature and concentration on the structure of N-methylacetamide - Water complexes: Near-infrared spectroscopic study
Czarnecki MA, Haufa KZ
Journal of Physical Chemistry A, 109(6), 1015, 2005
9 Effect of temperature and concentration on the structure of tert-butyl alcohol/water mixtures: Near-infrared spectroscopic study
Wojtkow D, Czarnecki MA
Journal of Physical Chemistry A, 109(36), 8218, 2005
10 Two-dimensional FT-NIR correlation study of hydrogen bonding in the butan-1-ol/water system
Czarnecki MA, Wojtkow D
Journal of Physical Chemistry A, 108(13), 2411, 2004