Miguel Carvajal
Miguel Carvajal
Universidad de Huelva, Centro Estudios Avanzados en Física, Matemáticas y Computación
確認したメール アドレス: dfa.uhu.es
タイトル
引用先
引用先
Vibrational energies for based on high level ab initio potential energy surfaces
H Lin, W Thiel, SN Yurchenko, M Carvajal, P Jensen
The Journal of chemical physics 117 (24), 11265-11276, 2002
792002
An extended SU (2) model for coupled Morse oscillators
M Carvajal, R Lemus, A Frank, C Jung, E Ziemniak
Chemical Physics 260 (1-2), 105-123, 2000
772000
SU (2) approximation to the coupling of Morse oscillators
A Frank, R Lemus, M Carvajal, C Jung, E Ziemniak
Chemical physics letters 308 (1-2), 91-98, 1999
721999
Rotation–vibration motion of pyramidal XY3 molecules described in the Eckart frame: Theory and application to NH3
SN Yurchenko‖, M Carvajal, P Jensen*, H Lin⊥, J Zheng, W Thiel*
Molecular Physics 103 (2-3), 359-378, 2005
672005
Potential parameters of PH3 obtained by simultaneous fitting of ab initio data and experimental vibrational band origins
SN Yurchenko, M Carvajal, P Jensen, F Herregodts, TR Huet
Chemical physics 290 (1), 59-67, 2003
642003
Rotational spectrum of 13C2-methyl formate (HCOO13CH3) and detection of the two 13C-methyl formate in Orion
M Carvajal, L Margulès, B Tercero, K Demyk, I Kleiner, JC Guillemin, ...
Astronomy & Astrophysics 500 (3), 1109-1118, 2009
582009
Rotational spectrum and tentative detection of DCOOCH3-methyl formate in Orion
L Margulès, TR Huet, J Demaison, M Carvajal, I Kleiner, H Møllendal, ...
The Astrophysical Journal 714 (2), 1120, 2010
512010
Ab initio dipole moment and theoretical rovibrational intensities in the electronic ground state of PH3
SN Yurchenko, M Carvajal, W Thiel, P Jensen
Journal of Molecular Spectroscopy 239 (1), 71-87, 2006
512006
Detection of vibrationally excited methyl formate in W51 e2
K Demyk, G Wlodarczak, M Carvajal
Astronomy & Astrophysics 489 (2), 589-600, 2008
502008
Dipole moment and rovibrational intensities in the electronic ground state of : Bridging the gap between ab initio theory and spectroscopic experiment
SN Yurchenko, M Carvajal, H Lin, J Zheng, W Thiel, P Jensen
The Journal of chemical physics 122 (10), 104317, 2005
472005
Rotation–vibration motion of pyramidal XY3 molecules described in the Eckart frame: The calculation of intensities with application to NH3
SN Yurchenko, W Thiel, M Carvajal, H Lin, P Jensen
Advances in Quantum Chemistry 48, 209-238, 2005
442005
Microwave and submillimeter spectroscopy and first ISM detection of 18O-methyl formate
B Tercero, L Margulès, M Carvajal, RA Motiyenko, TR Huet, EA Alekseev, ...
Astronomy & Astrophysics 538, A119, 2012
422012
Reinvestigation of the ground and first torsional state of methylformate
M Carvajal, F Willaert, J Demaison, I Kleiner
Journal of Molecular Spectroscopy 246 (2), 158-166, 2007
412007
Spectroscopic description of H2O in the su (2) vibron model approximation
R Lemus, M Carvajal, JC López-v, A Frank
Journal of Molecular Spectroscopy 214 (1), 52-68, 2002
372002
Global assignment and extension of millimeter-and submillimeter-wave spectral database of 13C1-methyl formate (H13COOCH3) in the ground and first excited states
M Carvajal, I Kleiner, J Demaison
The Astrophysical Journal Supplement Series 190 (2), 315, 2010
312010
Vibrational energies of calculated variationally at the complete basis set limit
RI Ovsyannikov, W Thiel, SN Yurchenko, M Carvajal, P Jensen
The Journal of chemical physics 129 (4), 044309, 2008
312008
PH3 revisited: Theoretical transition moments for the vibrational transitions below 7000cm-1
RI Ovsyannikov, W Thiel, SN Yurchenko, M Carvajal, P Jensen
Journal of Molecular Spectroscopy 252 (2), 121-128, 2008
282008
Simulation of the Raman spectra of CO2: Bridging the gap between algebraic models and experimental spectra
R Lemus, M Sánchez-Castellanos, F Pérez-Bernal, JM Fernández, ...
The Journal of Chemical Physics 141 (5), 054306, 2014
272014
Theoretical spectroscopic characterization at low temperatures of detectable sulfur-organic compounds: Ethyl mercaptan and dimethyl sulfide
ML Senent, C Puzzarini, R Domínguez-Gómez, M Carvajal, M Hochlaf
The Journal of Chemical Physics 140 (12), 124302, 2014
262014
Equivalent rotations associated with the permutation inversion group revisited: symmetry projection of the rovibrational functions of methane
O Álvarez-Bajo, R Lemus, M Carvajal, F Pérez-Bernal
Molecular Physics 109 (5), 797-812, 2011
262011
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論文 1–20