(C2H4)-C-13 molecule;
rovibrational spectrum;
parameters of the molecule Hamiltonian;
RO-VIBRATIONAL ANALYSIS;
MOLECULAR BANDS FORBIDDEN;
LOCAL-MODE;
ISOTOPE SUBSTITUTION;
POLYATOMIC-MOLECULES;
FTIR SPECTRUM;
GROUND-STATE;
HOT BANDS;
ETHYLENE-C-13(2);
REANALYSIS;
D O I:
10.1007/s11182-017-0914-0
中图分类号:
O4 [物理学];
学科分类号:
0702 ;
摘要:
High resolution (0.0025 cm(-1)) spectrum of the (C2H4)-C-13 molecule recorded in the 2330-2500 cm(-1) spectral region with a Bruker 120HR Fourier spectrometer is theoretically analyzed. The spectroscopic parameters of the (v(2) = v(10) = 1, B-2u) vibrational state of the molecule are determined for the first time by fitting the experimental data that allow the rotational energy values (529 rovibrational energies corresponding to 2400 transitions with J(max) = 30 and K-a (max) = 13) to be reproduced with accuracy close to experimental uncertainties.
机构:
Beijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Wu, Qunyan
Hao, Qiang
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USA
Beijing Normal Univ, Coll Chem, Beijing 100875, Peoples R ChinaBeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Hao, Qiang
Wilke, Jeremiah J.
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Wilke, Jeremiah J.
Simmonett, Andrew C.
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Simmonett, Andrew C.
Yamaguchi, Yukio
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Yamaguchi, Yukio
Li, Qianshu
论文数: 0引用数: 0
h-index: 0
机构:
Beijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
S China Normal Univ, Ctr Computat Quantum Chem, Guangzhou 510631, Peoples R ChinaBeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Li, Qianshu
Fang, De-Cai
论文数: 0引用数: 0
h-index: 0
机构:
Beijing Normal Univ, Coll Chem, Beijing 100875, Peoples R ChinaBeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Fang, De-Cai
Schaefer, Henry F., III
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
机构:
Univ Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, BelgiumUniv Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, Belgium
Dricot, Nicolas
Vispoel, Bastien
论文数: 0引用数: 0
h-index: 0
机构:
Univ Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, BelgiumUniv Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, Belgium
Vispoel, Bastien
Lepere, Muriel
论文数: 0引用数: 0
h-index: 0
机构:
Univ Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, BelgiumUniv Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, Belgium
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Ulenikov, O. N.
Gromova, O., V
论文数: 0引用数: 0
h-index: 0
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Gromova, O., V
Bekhtereva, E. S.
论文数: 0引用数: 0
h-index: 0
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Bekhtereva, E. S.
Raspopova, N., I
论文数: 0引用数: 0
h-index: 0
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Raspopova, N., I
Velmuzhova, I. A.
论文数: 0引用数: 0
h-index: 0
机构:
Russian Acad Sci, GG Devyatykh Inst Chem High Pur Subst, Nizhnii Novgorod 603950, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Velmuzhova, I. A.
Koshelev, M. A.
论文数: 0引用数: 0
h-index: 0
机构:
Russian Acad Sci, Inst Appl Phys, Nizhnii Novgorod 603950, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Koshelev, M. A.
Sennikov, P. G.
论文数: 0引用数: 0
h-index: 0
机构:
Russian Acad Sci, GG Devyatykh Inst Chem High Pur Subst, Nizhnii Novgorod 603950, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
机构:
Beijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Wu, Qunyan
Hao, Qiang
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USA
Beijing Normal Univ, Coll Chem, Beijing 100875, Peoples R ChinaBeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Hao, Qiang
Wilke, Jeremiah J.
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Wilke, Jeremiah J.
Simmonett, Andrew C.
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Simmonett, Andrew C.
Yamaguchi, Yukio
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Yamaguchi, Yukio
Li, Qianshu
论文数: 0引用数: 0
h-index: 0
机构:
Beijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
S China Normal Univ, Ctr Computat Quantum Chem, Guangzhou 510631, Peoples R ChinaBeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Li, Qianshu
Fang, De-Cai
论文数: 0引用数: 0
h-index: 0
机构:
Beijing Normal Univ, Coll Chem, Beijing 100875, Peoples R ChinaBeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
Fang, De-Cai
Schaefer, Henry F., III
论文数: 0引用数: 0
h-index: 0
机构:
Univ Georgia, Ctr Computat Quantum Chem, Athens, GA 30602 USABeijing Inst Technol, Inst Chem Phys, Beijing 100081, Peoples R China
机构:
Univ Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, BelgiumUniv Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, Belgium
Dricot, Nicolas
Vispoel, Bastien
论文数: 0引用数: 0
h-index: 0
机构:
Univ Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, BelgiumUniv Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, Belgium
Vispoel, Bastien
Lepere, Muriel
论文数: 0引用数: 0
h-index: 0
机构:
Univ Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, BelgiumUniv Namur, Inst Life Earth & Environm ILEE, Res Unit Lasers & Spect LLS, 61 Rue Bruxelles, B-5000 Namur, Belgium
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Ulenikov, O. N.
Gromova, O., V
论文数: 0引用数: 0
h-index: 0
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Gromova, O., V
Bekhtereva, E. S.
论文数: 0引用数: 0
h-index: 0
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Bekhtereva, E. S.
Raspopova, N., I
论文数: 0引用数: 0
h-index: 0
机构:
Natl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Raspopova, N., I
Velmuzhova, I. A.
论文数: 0引用数: 0
h-index: 0
机构:
Russian Acad Sci, GG Devyatykh Inst Chem High Pur Subst, Nizhnii Novgorod 603950, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Velmuzhova, I. A.
Koshelev, M. A.
论文数: 0引用数: 0
h-index: 0
机构:
Russian Acad Sci, Inst Appl Phys, Nizhnii Novgorod 603950, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia
Koshelev, M. A.
Sennikov, P. G.
论文数: 0引用数: 0
h-index: 0
机构:
Russian Acad Sci, GG Devyatykh Inst Chem High Pur Subst, Nizhnii Novgorod 603950, RussiaNatl Res Tomsk Polytech Univ, Res Sch High Energy Phys, Tomsk 634050, Russia