Journal of Molecular Spectroscopy

Article	Citations
The 2020 edition of the GEISA spectroscopic database	100
Laboratory gas-phase vibrational spectra of [C3H3]+ isomers and isotopologues by IRPD spectroscopy	15
The eight lowest-energy vibrational states of benzonitrile: analysis of Coriolis and Darling-Dennison couplings by millimeter-wave and far-infrared spectroscopy	14
Line intensities of the 01111–00001 magnetic dipole absorption band of 12C16O2: Laboratory measurements	14
Anharmonic infrared spectra of thermally excited pyrene (C16H10): A combined view of DFT-based GVPT2 with AnharmonicCaOs, and approximate DFT molecular dynamics with demonNano	14
Rotational spectroscopy of isotopic oxirane, c-C	13
A rotational and vibrational investigation of phenylpropiolonitrile (C6H5C3N)	12
The atmospheric continuum in the “terahertz gap” region (15–700 cm−1): Review of experiments at SOLEIL synchrotron and modeling	12
Mid-IR and VUV spectroscopic characterisation of thermally processed and electron irradiated CO2 astrophysical ice analogues	11
A chirped pulse Fourier transform microwave spectrometer with multi-antenna detection	11
The rotationally resolved infrared spectrum of TiO and its isotopologues	11
Structural characterization of [M,C,2H]+ products formed by reaction of 5d metal cations Pt+ and Ir+ with ethylene oxide and Ta+ with methane using messenger spectroscopy	11
Infrared spectroscopy of the benzylium-like (and tropylium-like) isomers formed in the –H dissociative ionization of methylated PAHs	10
Fourier transform infrared (FTIR) spectroscopy of formaldoxime (CH2NOH) in the 450–3800 cm−1 region and its	10
Inner-shell excitation in the YbF molecule and its impact on laser cooling	10
SOLEIL and ALMA views on prototypical organic nitriles: C2H5CN	10
Toward a global model of the interactions in low-lying states of methyl cyanide: Rotational and rovibrational spectroscopy of the 10
Laboratory IR spectroscopy of protonated hexa-peri-hexabenzocoronene and dicoronylene	9
Mid-infrared spectroscopic signatures of dibenzopyrene cations – The effect of symmetry on PAH IR spectroscopy	9
Vibrational spectroscopy of H2He+ and D2He+	8
Rotational spectroscopic studies of the tetrel bonded CH3CN-CO2 complex	8
Variational vibrational states of HCOOH	8
Infrared free-electron laser irradiation of carbon dioxide ice	8
Computational study of the rovibrational spectrum of H2<	7
Improved centrifugal and hyperfine analysis of ND2H and NH2D and its application to the spectral line survey of L1544	7

Study of vibrational spectra of polycyclic aromatic hydrocarbons with phenyl side group	7
VUV photoprocessing of oxygen-containing polycyclic aromatic hydrocarbons: Threshold photoelectron spectra	7
An investigation of inter-ligand coordination and flexibility: IRMPD spectroscopic and theoretical evaluation of calcium and nickel histidine dimers	6
The rotation-torsion spectrum of CD2HOH	6
Accurate equilibrium structures of some challenging molecules: FNO, ClNO, HONO, FNO2, and N2O	6
Benchmark comparison of dual-basis double-hybrid density functional theory and a neural-network-optimized method for intermolecular interactions	6
The pyrrole-water complex: Multidimensional large amplitude dynamics and rotational spectra of its 13C isotopologues	6
Cryogenic Messenger-IR Ion Spectroscopy Study of Phenol & Aniline Molecular Ions and of the common Fragment Ion [C5H6]+ formed by EI-MS	6
Precision millimetre-wave spectroscopy and calculation of the Stark manifolds in high Rydberg states of para-H6
Deciphering the rotational spectrum of the first excited torsional state of propylene oxide	6
An approach for multi-color action spectroscopy of highly excited states of	6
Millimeter-millimeter-wave double-modulation double-resonance spectroscopy	6
MARVEL analysis of high-resolution spectra of thioformaldehyde (H	6
Taming semi-empirical methods for PAHs and vibrational spectra	6
The simplest sulfur-nitrogen hydrogen bond: Matrix isolation spectroscopy of H2S·NH3	6
On the planarity of benzyl cyanide	6
Further rotational spectroscopy of phenol: Sextic centrifugal distortion and vibrational satellites	6
Infrared predissociation spectroscopy of protonated methyl cyanide, CH3CNH+	6
The 130–500 GHz rotational spectroscopy of cyanopyrazine (C4H3N2-CN)	6
Accurate calculation of the interaction of a barium monofluoride molecule with an argon atom: A step towards using matrix isolation of BaF for determining the electron electric dipole moment	6
Rovibrational spectra of Ar–SO2 and (SO2)2 van der Waals complexes in the v1 region of SO2	6
Rotational spectroscopy and precise molecular structure of 1,2-dichlorobenzene	5
Forbidden rotational transitions and astrophysics	5
Rotational and vibrational spectroscopy of 1-cyanoadamantane and 1-isocyanoadamantane	5
Cavity ring-down spectroscopy of l-type doubling in 15N-β-site N2O isotopomer near 7.8 µm	5
Variational rovibrational calculations for tetra atomic linear molecules using Watson’s isomorphic Hamiltonian: II. The B11244 story retold	5
Rotational spectrum and quantum chemical calculations of methyl cyanoacetate: A compound of potential astrochemical interest	5
Multi-reference and multi-occupancy character of the cobalt monofluoride	5
Rovibrational spectra of nonpolar (N2O)2 and Ar–N2O complexes in the 2v2 overtone region of N2O	5
High-resolution infrared action spectroscopy of the fundamental vibrational band of CN+	5
High-resolution Fourier transform infrared (FTIR) spectroscopy of formaldoxime-C (13CH2NOH): Ground and <	5
AI-3000K Infrared line list for hot CO2	5
Torsional motions of the free and H-bonded hydroxyl groups of the catechol molecule	5
Unpicking vibration-vibration and vibration-torsion interactions in m-fluorotoluene	5
Infrared spectroscopy of difference and combination bands of the NO3 radical and anharmonicity analysis	4
Broadband microwave spectroscopy of cyclopentylsilane and 1,1,1-trifluorocyclopentylsilane	4
Analytical expression of tensorial rotational operators for semi-classical interpretation of molecular spectra. Relations between molecular Hamiltonian parameters in different formalisms	4
Structure and conformations of 3-methylcatechol: A rotational spectroscopic and theoretical study	4
Ab initio potential energy surface and vibration-rotation energy levels of magnesium monohydroxide revisited	4
Ro-vibrational spectra of C C stretching modes of C3H＋ and HC3O＋	4
Rovibrational analysis of the ν12 and 2	4
Theoretical investigation of the vibrational structure of the Ar–CO2 complex	4
LLWP—A new Loomis-Wood software at the example of Acetone-13C1	4
Simulation of the dispersed fluorescence spectrum of the NO	4
Parent, 34S, and deuterated triflic acid: Microwave spectra and tunneling splittings due to hydroxyl torsion	4
Weakly bound complexes of selenophene with water as seen in matrix isolation FTIR	4
Vibrations of pyrrole, N-substituted pyrroles, and their cations	4
Analysis of high-resolution spectra of SiF4 combination bands	4
A high speed fitting program for rotational spectroscopy	4
Study on theoretical analysis of C4F7N infrared spectra and detection method of mixing ratio of the gas mixture	4

The microwave spectra and molecular structures of (E)-1,3,3,3-tetrafluoropropene and its complex with the argon atom	4
The 130–500 GHz rotational spectrum of 2-cyanopyrimidine	4
The chirped pulse, Fourier transform microwave spectrum of 1-chloromethyl-1-fluorosilacyclopentane	4
A prochiral precursor in space? Accurate laboratory characterization of acetylacetylene in the cm-wave region	4
Cavity ring-down spectroscopy study of neon assisted recombination of 4
Buffer-gas pressure broadening at high J values in the ν3 band of CO2 measured with tunable diode laser absorption spectroscopy	4
Matrix-isolation infrared study of acetaldehyde: Host-dependent vibrational features	4
Microwave measurements, calculations, and analysis for the gas phase ammonia-formic acid dimer	4
Self-broadening and self-shift in the 3ν<	4
The fundamental rotational transition of NO+	4
New potential candidates for astronomical searches discovered in the electrical discharge of the PAH naphthalene and acetonitrile	4
Evidence of anharmonicity in the vibrational spectrum of protonated ethylene	3
Rotational spectra of twenty-one vibrational states of [35Cl]-and [37Cl]-chlorobenzene	3
The 2,2,4,4-tetrafluoro-1,3-dithietane⋯NH3 complex: A rotational study reveals a N⋯σ-hole interaction	3
The new nitrogen dioxide (NO2) linelist in the GEISA database and first identification of the ν1+2ν3-ν3 band of 14N16O2	3
High-resolution rovibrational spectroscopy of trans-formic acid in the v1 OH stretching fundamental: Dark state coupling and evidence for charge delocalization dynamics	3
High-Resolution spectroscopy and analysis of the fundamental modes of	3
Helium nanodroplet isolation spectroscopy in an undergraduate teaching laboratory	3
Absolute frequency measurement of the 3ν1 band of N2O with comb-locked rapid scan spectroscopy using a multi-pass cell	3
Rovibrational spectroscopy of the CH+-He and CH+-He4 complexes	3
A free electron laser-based 1+1′ Resonance-Enhanced Multiphoton Ionization scheme for rotationally resolved detection of OH radicals with correct relative intensities	3
Laser induced fluorescence spectra of the B	3
The water vapor self-continuum in the “terahertz gap” region (15–700 cm−1): Experiment versus MT_CKD-3.5 model	3
Line mixing study of carbon monoxide near 4.	3
Rotation-tunneling spectra and barriers of isotopologues of 2,2,2-trifluoroethanol and 2,2,3,3,3-pentafluoropropanol	3
Anion photoelectron spectroscopic and relativistic coupled-cluster studies of uranyl dichloride anion, UO3
High-resolution laser-induced fluorescence spectroscopy of 28Si16O+ and 29Si16O+ in a cryogenic buffer-gas cell	3
Improved potential-energy and dipole-moment functions of the ground electronic state of phosphorus nitride	3
The microwave spectra and molecular structures of (E)-1-chloro-1,2-difluoroethylene and its complex with the argon atom	3
High resolution threshold photoelectron spectrum and autoionization processes of S2 up to 15.0 eV	3
The microwave spectra and molecular structures of the chiral and achiral rotamers of 2,3,3-trifluoropropene and their gas-phase heterodimers with the argon atom	3
Multiple helium tagging and OH vibrational spectroscopy of cold protonated glycine ions	3
Rotational spectrum of anti- and gauche-4-cyano-1-butyne (C5H5N) – An open-chain isomer of pyridine	3
Rotational spectroscopy of imidazole: Accurate spectroscopic information for three vibrationally excited states and the heavy-atom isotopologues up to 295 GHz	3
Submillimeter wave spectroscopy of propanoic acid (CH3CH2COOH) and its ISM search	3
c-AlO2, c-HAlO	3
Structure and photochemistry of a potential precursor of circumstellar dust: The optical spectrum of Si4C2+	3
Rotational spectroscopy of oxirane-2,2-d	3
Microwave measurements and calculations for the glyoxylic acid – Formic acid hydrogen-bonded complex	3
A local Gaussian Processes method for fitting potential surfaces that obviates the need to invert large matrices	3
Microwave Zeeman effect of methanol	3
Rotational spectroscopy and bound state calculations of deuterated NH3–H2 van der Waals complexes	3
(Sub-)millimeter-wave spectroscopy of gauche-propanal	3
Conformational analysis of cyclohexyl hydroperoxide by rotational spectroscopy	3
High-resolution infrared study of vinyl acetylene: The ν	3
The bending of C3: Experimentally probing the l-type doubling and	3
Rotational spectra of singly substituted rare isotopologues of two conformers of 3,3,3-trifluoropropanol	3
High-resolution spectroscopy of the X 0	3
Structure and nuclear quadrupole coupling interaction in hydroxylamines: The rotational spectrum of N,N-diethyl(2H)hydroxylamine	3
Millimeter-wave and infrared spectroscopy of thiazole (c-C3H3NS) in its ground state and lowest-energy vibrationally excited states (ν18, ν17, and ν13)	3
Investigation of the global second-derivative non-adiabatic contributions: Rovibrational energies of	3
IRMPD spectroscopy of a PAH cation using FELICE: The infrared spectrum and photodissociation of dibenzo[a,l]pyrene	2
Chirped-pulse Fourier-transform millimeter-wave rotational spectroscopy of furan in its v10 and v13 excited vibrational states	2
Theoretical rovibrational characterization of HAlNP: Weak bonding but strong intensities	2
High-resolution FT-VIS emission spectroscopy of the A	2
Improvement and determination of higher-order centrifugal distortion constants of the	2
Ab initio potential energy surface and microwave spectra for Kr-NCCN complex	2
Observation and analysis of a new [14.26]0+ – X 3Σ–0+ transition of WS, observed using intracavity laser spectroscopy with Fourier-transform detection	2
Watson’s papers on the vibration-rotation interaction	2
Hydrogen bonding interactions in the 1,1,1,3,3,3-hexafluoro-2-propanol∙∙∙1,4-dioxane complex: Rotational spectroscopy and density functional theory calculations	2
An empirical spectroscopic model for eleven electronic states of VO	2
Spin-orbit splitting of the ground state of WO	2
High-resolution laser spectroscopy of the A	2
The microwave spectra and molecular structures of (Z)-1-chloro-3,3,3-trifluoropropene and its gas-phase heterodimer with the argon atom	2
Rotational and hyperfine analysis of the D2	2
Infrared spectra of (CO2)2 – Rg trimers, Rg = Ne, Ar, Kr, and Xe	2
Analysis of the (0,0) band of the new [15.3]Ω=3/2 – X 2Π3/2 electronic transition of PtF using intracavity laser spectroscopy	2
Microwave spectrum and iodine nuclear quadrupole coupling constants of 1,1-diiodoethane	2
Experimental observation of the ν2+4ν3 bands of HD16O and HD18O between 14975 and 15275 cm−1	2
Mapping extended reaction coordinates in photochemical dynamics	2
Measurements and calculations of xenon broadening and shift parameters of water vapour transitions for ν1 + ν2 + ν3 band	2
The microwave spectrum of the low energy conformers of 1-ethylsilacyclopentane	2
Measurements of perfluoro-n-heptane and perfluoro-n-octane absorption cross-sections from 300 to 350 K	2
Analysis of the accuracy of calculations using Duo and Level diatomic nuclear motion programs	2
The microwave spectrum of the difluorocyanomethyl radical, ĊF2CN	2
The 130–360 GHz rotational spectrum of isocyanocyclobutane (C4H7NC) and cyanocyclobutane (C4H7CN)	2
Laboratory microwave spectroscopy of the doubly deuterated cyanomethyl radical, D2CCN	2
Predicting the rotational dependence of line broadening using machine learning	2
Millimeter-wave spectroscopy of the 13CH3OD isotopic species of methyl alcohol	2
Laser induced amplified spontaneous emission between the ion-pair states of Cl2	2

Fourier transform synchrotron spectroscopy of the COD-bending fundamental of CD3OD	2
Conformational flexibility and hydrogen bonding in 5-aminopentanol	2
Variational analysis of HF dimer tunneling rotational spectra using an ab initio potential energy surface	2
Absorption cross-sections, radiative efficiency and global warming potential of HFE-347pcf2 (1,1,2,2-tetrafluoroethyl 2,2,2-trifluoroethyl ether)	2
Effective and equilibrium structures of XY -type molecules: SCl2, PF2, PO2, ZrO2, and CF2S as additional example and nonbonded distances F…F, Cl…Cl and O…O	2
Experimental and quantum-chemical characterization of heavy carbon subchalcogenides: Infrared detection of SeC3Se	2
Absorption spectrum of H2 between the third and the fourth dissociation thresholds (132 500 – 139 000 cm−1)	1
The database of spectroscopic constants of diatomic molecules (DSCDM): A dynamic and user-friendly interface for molecular physics and spectroscopy	1
The high-resolution infrared analysis of the ν3 and ν6 bands of CD3Br	1
High resolution laser spectroscopy of iodine molecule in the 14	1
The pressure effect on the line profiles observed in the	1
Photon spin molasses for laser cooling molecular rotation	1
Analysis of the rotationally-resolved infrared spectrum of CD379Br and CD381Br between 900 and 1400 cm−1	1
A study of the conformational isomerism of n-propyl nitrate by microwave spectroscopy	1
Millimeter wave spectroscopy of propynal isotopologues and structure determination	1
westerfit: A new program for spin–torsion–rotation spectra	1
Rovibrational spectrum and structure of the NO(X2Π)–CO2 open-shell complex	1
Infrared action spectroscopy of fundamental nitrilium ions: Protonated vinyl- and ethyl cyanide	1
N2O–Ar and N2O–Kr: Intermolecular vibrations of N2O–Kr and symmetry breaking of the N2O bending mode in the presence of a rare gas	1
Diborane anharmonic vibrational frequencies and Intensities: Experiment and theory	1
Microwave spectra of two conformers of the (1R)-(–)-nopol monomer	1
Spectroscopic observation and ab initio calculations of a new isomer of the CS2 trimer	1
Conformational analysis of carboxylic acid anhydrides: A microwave and computational study	1
The conformational landscape of α-aminoglycine	1
First investigation of the ν1, ν1-ν9, ν1+ν9, and ν1+ν7 absorption bands of nitric acid (1H14N16O3) at 3551.766 cm−1, 3092.708 cm−1, 4006.974 cm−1, and 4127.782 cm−1, respectively	1
The 130 – 750 GHz rotational spectrum of 2-cyanopyridine – Analysis of the ground vibrational state and the Coriolis-coupled dyad of its lowest-energy fundamental states	1
Measurements of perfluoro-n-hexane and perfluoro-2-methylpentane infrared absorption cross-sections from 298 to 350 K	1
Rovibrational jet-cooled spectroscopy of the Kr–H2O van der Waals complex in the ν	1
MARVEL analysis of the high-resolution rovibrational spectra of H16O35Cl	1
Vibrational spectroscopy of aniline cations and their H-loss cations in helium droplets	1
The microwave spectrum and molecular structure of the gas-phase heterodimer formed between argon and glycidol	1
Mono- and di-deuterated ammonias: Far-infrared spectra and spectroscopic parameters in the ground state	1
Part 2:Validation for line lists generated for nitric acid (H14N16O3) for the ν1 band and its first two associated hot bands (ν1+ν9-ν9, ν1+ν7-ν7) in the 2.8 μm region, the ν1-ν9, ν1+ν9 and ν1+ν7 bands	1
Spectral line-shape analysis of CO2 transition using Hartmann-Tran profile and its asymptotic limits	1
Re-investigation of the infrared spectrum of the NCN radical by laser magnetic resonance spectroscopy	1
Threshold photoelectron spectroscopy and density functional theory studies on the CF2Cl2 ionization energies towards the B2B1 and C2A1 ionic states	1
Spectroscopic study of the F1	1
Conformational landscapes of symmetrically fluorine-substituted benzoic acids II: Calculations and measurements for the rotational spectrum and structure of 3,4,5-trifluorobenzoic acid	1
Rotational spectroscopic studies of para-nitrobenzoic acid, para-aminobenzoic acid, para-chlorobenzoic acid, and para-hydroxybenzoic acid	1
Variational rovibrational calculations for tetra atomic linear molecules using Watson’s isomorphic Hamiltonian, I: The C8v4 approach	1
Conformational landscape and internal dynamics of limona ketone, a key oxidation product of limonene	1
Diode laser measurements of high-temperature line strength and self-broadening coefficient of carbon dioxide near 2.0 μm	1
High-resolution far-infrared synchrotron FTIR spectroscopy and analysis of the	1
Erratum to “Line intensities of the radioactive isotopologues of carbon monoxide” by E.V. Karlovets and V.I. Perevalov [J. Mol. Spectrosc. 364 (2019) 111184]	1
Joint survey of the experimental high-resolution spectra of H16O37Cl and H16O35Cl with a reanalysis of the	1
H2O-HF dimer r	1
Fourier transform infrared (FTIR) spectroscopy of formaldoxime isotopologue 12CD2NOH in the 300–3700 cm−1 region and its ν12 and ν9 bands: Vibrational and rovibrational analyses	1
Spectroscopy and electronic structure of the low-energy states of ThN	1
Absorption cross-sections for the 5th and 6th vibrational overtones in a series of short chained alcohols using incoherent broadband cavity enhanced-absorption spectroscopy (IBBCEAS)	1
Rovibrational spectra of SO2-containing van der Waals complexes in the v1 region of SO2. Part I. N2-SO2 and OC-SO2	1
The C2H4O isomers in the oxidation of ethylene	1
The millimeter-wave spectrum of doubly deuterated propylene oxide	1
Microwave spectrum and structure of a glyoxylic acid – formic acid complex☆	1
On the formation and spectral signatures of magnesacyclopropene (c-MgC	1
Accurate equilibrium structures of linear triatomic molecules from a combined theoretical–experimental method: The protonated nitrogen molecule, HN1
Ammonia – Formic acid complex: internal rotation analysis, calculations, and new microwave measurements	1
The analysis of the microwave absorption spectrum of trans-ethyl methyl ether in the skeletal torsion v30 = 2 state	1
The microwave spectra of the conformers of n-butyl nitrate	1
Spectroscopic and theoretical study of the intramolecular π-type hydrogen bonding and conformations of 3-cyclohexen-1-ol	1
Te2 absorption spectrum from 19000 to 24000 cm−1	1
Ligand-protected gold nanoclusters probed by IRMPD spectroscopy and quantum chemistry calculations	1
Synchrotron-based infrared spectroscopy of the Coriolis perturbed ν6 and ν8 bands of trans-DCOOH	1
Cooperative pentavalent pnicogen bonding versus dominant hydrogen bonding in POCl3-diethylether dimer characterized using matrix isolation infrared spectroscopy and ab initio computations	1
Analysis of the newly observed [15.05]0+ – X3Σ–(0+) transition of WS observed using intracavity laser spectroscopy with Fourier-transform detection	1
High-resolution absorption spectroscopy of room-temperature and jet-cooled ammonia between 59,000 and 93,000 cm−1	1
A study of the local to normal mode transition in pyramidal molecules and their vibrational description in terms of an algebraic model	1
The microwave spectrum of the sesamol (1,3-benzodioxol-5-ol) monomer and an analysis of its internal motion	1
Analysis of the calculated and observed X-X ro-vibrational transition intensities in molecular hydrogen	1
Analysis of the 0-0, 1-0, and 2-0 Bands of the [18.09]4 (5Δ4) -X4 (5Δ4) and [18.46]3 (5Δ3) – X3 (5Δ3) transitions of ruthenium monoxide (RuO)	1
Synchrotron-based rotation-vibration spectroscopy of imidazole	1
Relaxed and local mode force constants: Linear ABC as a model system	1