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Theoretical investigation of the ground state dissociation pathways of CH2NO2. 568:111823-111823. 2023
Ring-puckering potential energy functions for cyclobutane and related molecules based on refined kinetic energy expansions and theoretical calculations. 532:110647-110647. 2020
Dielectric properties of acetonitrile confined in carbon nanotubes. 530:110598-110598. 2020
Structural, optical and photocatalytic properties of La0.7Ba0.3MnO3 nanoparticles prepared by microwave method. 529:110576-110576. 2020
Theoretical analysis of the stabilization of graphene nanosheets by means of strongly polarized pyrene derivatives. 527:110468-110468. 2019
Empirical assignment of absorbing electronic state contributions to OCS photodissociation product state populations from 214 to 248 nm. 520:1-7. 2019
Luminescence of ND radicals during the destruction of molecular nitrogen nanoclusters. 516:33-37. 2019
6.2 mu m spectrum and 6-dimensional morphed potentials of OC-H2O. 501:35-45. 2018
The role of near resonance electronic energy transfer on the collisional quenching of NO (A(2)Sigma(+)) by C6H6 and C6F6 at low temperature. 501:86-92. 2018
The complex-scaled multiconfigurational spin-tensor electron propagator method for low-lying shape resonances in Be-, Mg- and Ca-. 482:201-207. 2017
A canonical approach to forces in molecules. 474:52-58. 2016
A canonical approach to multi-dimensional van der Waals, hydrogen-bonded, and halogen-bonded potentials. 469:60-64. 2016
Infrared, Raman, and Ultraviolet Absorption Spectra and Theoretical Calculations and Structure of 2,3,5,6-Tetrafluoropyridine in its Ground and Excited Electronic States.. 456:28-33. 2015
Vibrational effects in the shape resonant photoionization leading to the A(2)T(1u) state of SF6+. 447:64-70. 2015
Theoretical calculations, far-infrared spectra and the potential energy surfaces of four cyclic silanes. 431:15-19. 2014
Compound model-morphed potentials contrasting OC-(BrCl)-Br-79-Cl-35 with the halogen bonded OC-Cl-35(2) and hydrogen-bonded OC-HX (X=F-19, Cl-35, Br-79). 425:162-169. 2013
Optical and THz signatures of sub-cycle tunneling dynamics. 414:92-99. 2013
Studies of low-frequency intermolecular hydrogen-bonded vibrations using a continuous supersonic slit jet mid-infrared quantum cascade laser spectrometer. 409:1-10. 2012
Vibrational state-selected photodissociation of ClO+. 408:43-49. 2012
Theoretical investigation on electron scattering by benzene in the intermediate-energy range. 393:19-24. 2012
Morphing a vibrationally-complete ground state potential for the hydrogen bond OC-HF. 390:42-50. 2011
Cross sections and asymmetry parameters for photoionization of CH3F in the VUV region. 358:96-102. 2009
Ion imaging studies of ClONO2 photodissociation: Primary branching ratios and secondary dissociation. 364:90-97. 2009
Ultrafast laser excitation and rotational de-excitation of cis-stilbene. 353:104-108. 2008
Rotational analysis of the (57,0) band of the D1(u) <- X0(g)(+) triplet-singlet transition in Hg-2 produced in a free-jet expansion beam. 348:103-112. 2008
Spectroscopic properties of dipicolinic acid and its dianion. 322:254-268. 2006
Ultrafast X-ray determination of transient structures in solids and liquids. 299:203-213. 2004
The unimolecular dissociation of 2-butenenitrile: measurements of the CN elimination channel using FM Doppler spectroscopy. 254:309-317. 2000
The ultraviolet photodissociation dynamics of IBr studied using state-selective translational spectroscopy. 249:237-248. 1999
Complete basis set limit ionization potentials of O-3 and NO2 using the multiconfigurational spin tensor electron propagator method (MCSTEP). 238:1-9. 1998
An ab initio molecular orbital study of the reaction NH2+NO -> H-2+N2O. 228:9-16. 1998
Energy partitioning in photodissociation of methyl, ethyl, and n-propyl iodides at 304 nm - Comment. 211:515-516. 1996
LUMINESCENCE OF NITROGEN AND NEON ATOMS ISOLATED IN SOLID HELIUM. 189:367-382. 1994
THE ULTRAVIOLET PHOTODISSOCIATION DYNAMICS OF PYRROLE. 187:35-47. 1994
METASTABLE IMPURITY-HELIUM SOLID-PHASE - EXPERIMENTAL AND THEORETICAL EVIDENCE. 170:411-426. 1993
A MULTICONFIGURATIONAL LINEAR RESPONSE STUDY OF N2. 136:385-397. 1989
PHOTOIONIZATION CROSS-SECTIONS INVOLVING AN EXPLICITLY CORRELATED INITIAL STATE - COMBINATION OF MULTICONFIGURATIONAL LINEAR RESPONSE AND THE STIELTJES-CHEBYSHEV MOMENT THEORY. 110:339-354. 1986
MULTIPLE STATIONARY POINT REPRESENTATIONS IN MC SCF CALCULATIONS. 93:83-100. 1985
PROPER CHARACTERIZATION OF MC SCF STATIONARY-POINTS. 78:175-199. 1983
EXCITED-STATE PROPERTIES FROM THE EQUATIONS OF MOTION METHOD - APPLICATION OF THE MCTDHF-MCRPA TO THE DIPOLE-MOMENTS AND OSCILLATOR-STRENGTHS OF THE ALPHA1-PI,ALPHA3-PI,ALPHA'-SIGMA+ AND D3-DELTA LOW-LYING VALENCE STATES OF CO. 64:69-81. 1982
MODELING OF RELAXATION MEASUREMENTS ON HIGHLY VIBRATIONALLY EXCITED HD USING DIRECT OVERTONE PUMPING AND PHOTOACOUSTIC DETECTION. 51:121-130. 1980
ANALYSIS OF 3RD ORDER CONTRIBUTIONS TO EQUATIONS OF MOTION - GREENS FUNCTION IONIZATION-POTENTIALS - APPLICATION TO N-2. 29:77-96. 1978
SHAKE-UP PEAK POSITIONS AND INTENSITIES BY MANY-BODY THEORY METHODS. 32:437-449. 1978
ANALYSIS OF 3RD ORDER CONTRIBUTIONS TO EQUATIONS OF MOTION GREENS FUNCTION EXCITATION-ENERGIES - APPLICATION TO N2. 22:415-433. 1977
WAVEFUNCTION APPROACH TO EQUATIONS OF MOTION GREENS FUNCTION METHODS. 22:401-414. 1977