Some Photochemical Reactions of O 3 in the Gas Phase
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January 1962 |
THE PHOTOLYSIS OF CO 2 AT 1 470 Å
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August 1966 |
Reaction of O( 1 D ) with CO 2 at Low Temperatures
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September 1967 |
Infrared Spectrum and Structure of the Species CO 3
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February 1971 |
On the formation of higher carbon oxides in extreme environments
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November 2008 |
Observation of a mass independent oxygen isotopic composition in terrestrial stratospheric CO 2 , the link to ozone chemistry, and the possible occurrence in the Martian atmosphere
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February 1995 |
Remote sounding of the Martian dust from ISO spectroscopy in the bands
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January 2002 |
Identification of the D3h Isomer of Carbon Trioxide (CO3) and Its Implications for Atmospheric Chemistry
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October 2006 |
Ozone and carbon trioxide synthesis by low energy ion implantation onto solid carbon dioxide and implications to astrochemistry
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August 2013 |
Electronic Structure of Carbon Trioxide and Vibronic Interactions Involving Jahn−Teller States
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August 2007 |
Combined Jahn−Teller and Pseudo-Jahn−Teller Effect in the CO 3 Molecule: A Seven-State Six-Mode Problem
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August 2009 |
Pseudo Jahn-Teller coupling in trioxides XO 3 (0,1,−1) with 22 and 23 valence electrons
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May 2013 |
Pseudo-Jahn–Teller Effect—A Two-State Paradigm in Formation, Deformation, and Transformation of Molecular Systems and Solids
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January 2013 |
Negative ion photoelectron spectroscopy confirms the prediction that D 3h carbon trioxide (CO 3 ) has a singlet ground state
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January 2016 |
Vibronic interactions in the NO 3 radical
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July 1991 |
Examination of the 2 A ’ 2 and 2 E ‘ states of NO 3 by ultraviolet photoelectron spectroscopy of NO − 3
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February 1991 |
On the vibronic level structure in the NO3 radical. I. The ground electronic state
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April 2007 |
Towards a higher-order description of Jahn–Teller coupling effects in molecular spectroscopy: The state of NO3
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May 2008 |
On the vibronic level structure in the NO3 radical : Part III. Observation of intensity borrowing via ground state mixing
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January 2009 |
On the vibronic level structure in the NO 3 radical: II. Adiabatic calculation of the infrared spectrum
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April 2009 |
Full-dimensional diabatic potential energy surfaces including dissociation: The 2 E ″ state of NO 3
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June 2014 |
Jet cooled cavity ringdown spectroscopy of the A˜2E″←X˜2A2′ transition of the NO 3 radical
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May 2015 |
Vibronic eigenstates and the geometric phase effect in the 2 E″ state of NO 3
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January 2017 |
NO3 full-dimensional potential energy surfaces and ground state vibrational levels revisited
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June 2018 |
Conditions for the definition of a strictly diabatic electronic basis for molecular systems
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December 1982 |
Block diagonalization of the equation-of-motion coupled cluster effective Hamiltonian: Treatment of diabatic potential constants and triple excitations
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June 2014 |
A simple quasi-diabatization scheme suitable for spectroscopic problems based on one-electron properties of interacting states
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February 2016 |
A quantum chemical determination of diabatic states
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September 1993 |
Model space diabatization for quantum photochemistry
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February 2015 |
The direct calculation of diabatic states based on configurational uniformity
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January 2001 |
Direct diabatization of electronic states by the fourfold way. II. Dynamical correlation and rearrangement processes
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September 2002 |
Quantifying the effects of higher order coupling terms on fits using a second order Jahn-Teller Hamiltonian
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January 2018 |
Effects of higher order Jahn-Teller coupling on the nuclear dynamics
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March 2004 |
Higher order (A+E)⊗e pseudo-Jahn–Teller coupling
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May 2005 |
Jahn–Teller and spin–orbit coupling effects in transition-metal trifluorides
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August 2011 |
Ab initio study of dynamical E × e Jahn-Teller and spin-orbit coupling effects in the transition-metal trifluorides TiF 3 , CrF 3 , and NiF 3
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February 2012 |
The Jahn-Teller effect in CH 3 Cl +(X̃E2): A combined high-resolution experimental measurement and ab initio theoretical study
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February 2012 |
High-order expansion of T2×t2 Jahn–Teller potential-energy surfaces in tetrahedral molecules
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April 2010 |
High-order expansion of <mml:math altimg="si5.gif" display="inline" overflow="scroll" xmlns:xocs="http://www.elsevier.com/xml/xocs/dtd" xmlns:xs="http://www.w3.org/2001/XMLSchema" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns="http://www.elsevier.com/xml/ja/dtd" xmlns:ja="http://www.elsevier.com/xml/ja/dtd" xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:tb="http://www.elsevier.com/xml/common/table/dtd" xmlns:sb="http://www.elsevier.com/xml/common/struct-bib/dtd" xmlns:ce="http://www.elsevier.com/xml/common/dtd" xmlns:xlink="http://www.w3.org/1999/xlink" xmlns:cals="http://www.elsevier.com/xml/common/cals/dtd"><mml:mrow><mml:msub><mml:mrow><mml:mi>T</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub><mml:mo>×</mml:mo><mml:mi>e</mml:mi></mml:mrow></mml:math> Jahn–Teller potential-energy surfaces in tetrahedral systems
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July 2010 |
On the Jahn–Teller effect in the electronic ground state of CH3F+
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January 2017 |
On the higher-order T 2 ⊗ (e + t 2 ) Jahn–Teller coupling effects in the photodetachment spectrum of the alanate anion (AlH 4 − )
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January 2018 |
Revisiting the (E + A) ⊗ (e + a) problems of polyatomic systems with trigonal symmetry: general expansions of their vibronic Hamiltonians
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January 2017 |
General Formalism of Vibronic Hamiltonians for Tetrahedral and Octahedral Systems: Problems That Involve T , E States and t , e Vibrations
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September 2017 |
General formalism of vibronic Hamiltonians for tetrahedral and octahedral systems: Problems that involve A-type states and a-type vibrations
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November 2018 |
General formalism for vibronic Hamiltonians in tetragonal symmetry and beyond
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January 2018 |
Photoionization-induced dynamics of ammonia: Ab initio potential energy surfaces and time-dependent wave packet calculations for the ammonia cation
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June 2006 |
Density‐functional thermochemistry. I. The effect of the exchange‐only gradient correction
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February 1992 |
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
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January 1988 |
Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
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January 1989 |
Quantum dynamics on a three-sheeted six-dimensional ab initio potential-energy surface of the phosphine cation: Simulation of the photoelectron spectrum and the ultrafast radiationless decay dynamics
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November 2015 |
Quasi-degenerate perturbation theory withgeneral multiconfiguration self-consistent field reference functions
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June 2002 |
Relativistic quasidegenerate perturbation theory with four-component general multiconfiguration reference functions
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January 2006 |
Efficient implementation of relativistic and non-relativistic quasidegenerate perturbation theory with general multiconfigurational reference functions
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July 2007 |
A diabatization protocol that includes spin-orbit coupling
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April 2017 |
Dyson orbitals for ionization from the ground and electronically excited states within equation-of-motion coupled-cluster formalism: Theory, implementation, and examples
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December 2007 |
The multi-configurational time-dependent Hartree approach
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January 1990 |
The multiconfiguration time-dependent Hartree (MCTDH) method: a highly efficient algorithm for propagating wavepackets
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January 2000 |
On the determination of Born–Oppenheimer nuclear motion wave functions including complications due to conical intersections and identical nuclei
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March 1979 |
Quantal Phase Factors Accompanying Adiabatic Changes
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March 1984 |
Geometric phase effects and wave packet dynamics on intersecting potential energy surfaces
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December 1995 |
Geometric phases and quantum dynamics in spin–orbit coupled systems
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January 1998 |
Geometric Phase Effects in Nonadiabatic Dynamics near Conical Intersections
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June 2017 |
Berry’s geometrical phase and the sequence of states in the Jahn-Teller effect
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February 1987 |
Multiconical Intersections and Nondegenerate Ground State in Jahn-Teller Systems
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October 1999 |