Vibrational energy levels of the simplest Criegee intermediate (CH2OO) from full-dimensional Lanczos, MCTDH, and MULTIMODE calculations

An experimental and theoretical study on rotational constants of vibrationally excited CH 2 OO

(2015) Masakazu Nakajima et al.   CHEMICAL PHYSICS LETTERS

The physical chemistry of Criegee intermediates in the gas phase

(2015) David L. Osborn et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

A novel and facile decay path of Criegee intermediates by intramolecular insertion reactions via roaming transition states

(2015) Trong-Nghia Nguyen et al.   JOURNAL OF CHEMICAL PHYSICS

Infrared spectrum of the simplest Criegee intermediate CH2OO at resolution 0.25 cm−1 and new assignments of bands 2ν9 and ν5

(2015) Yu-Hsuan Huang et al.   JOURNAL OF CHEMICAL PHYSICS

Perspective: Spectroscopy and kinetics of small gaseous Criegee intermediates

(2015) Yuan-Pern Lee   JOURNAL OF CHEMICAL PHYSICS

Ab initio computational spectroscopy and vibrational dynamics of polyatomic molecules: Applications to syn and anti-CH3CHOO and NO3

(2015) Joel M. Bowman et al.   JOURNAL OF MOLECULAR SPECTROSCOPY

Production of and Dissociative Electron Attachment to the Simplest Criegee Intermediate in an Afterglow

(2015) Justin P. Wiens et al.   Journal of Physical Chemistry Letters

Direct kinetic measurement of the reaction of the simplest Criegee intermediate with water vapor

(2015) W. Chao et al.   SCIENCE

Infrared identification of the Criegee intermediates syn- and anti-CH3CHOO and their distinct conformation-dependent reactivity

(2015) Hui-Yu Lin et al.   Nature Communications

Calculation of the vibrational excited states of malonaldehyde and their tunneling splittings with the multi-configuration time-dependent Hartree method

(2014) Markus Schröder et al.   JOURNAL OF CHEMICAL PHYSICS

UV absorption spectrum of the C2 Criegee intermediate CH3CHOO

(2014) Mica C. Smith et al.   JOURNAL OF CHEMICAL PHYSICS

Quantum dynamical investigation of the simplest Criegee intermediate CH2OO and its O–O photodissociation channels

(2014) Kousik Samanta et al.   JOURNAL OF CHEMICAL PHYSICS

A full-dimensional multilayer multiconfiguration time-dependent Hartree study on the ultraviolet absorption spectrum of formaldehyde oxide

(2014) Qingyong Meng et al.   JOURNAL OF CHEMICAL PHYSICS

Direct production of OH radicals upon CH overtone activation of (CH3)2COO Criegee intermediates

(2014) Fang Liu et al.   JOURNAL OF CHEMICAL PHYSICS

Submillimeter measurements of the Criegee intermediate CH2OO, in the gas phase

(2014) Adam M. Daly et al.   JOURNAL OF MOLECULAR SPECTROSCOPY

High-Level, First-Principles, Full-Dimensional Quantum Calculation of the Ro-vibrational Spectrum of the Simplest Criegee Intermediate (CH2OO)

(2014) Jun Li et al.   Journal of Physical Chemistry Letters

Direct Determination of the Simplest Criegee Intermediate (CH2OO) Self Reaction Rate

(2014) Zachary J. Buras et al.   Journal of Physical Chemistry Letters

UV Absorption Spectrum and Photodissociation Channels of the Simplest Criegee Intermediate (CH2OO)

(2014) Richard Dawes et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Extremely rapid self-reaction of the simplest Criegee intermediate CH2OO and its implications in atmospheric chemistry

(2014) Yu-Te Su et al.   Nature Chemistry

The UV absorption spectrum of the simplest Criegee intermediate CH2OO

(2014) Wei-Lun Ting et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

UV absorption probing of the conformer-dependent reactivity of a Criegee intermediate CH3CHOO

(2014) Leonid Sheps et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Infrared-driven unimolecular reaction of CH3CHOO Criegee intermediates to OH radical products

(2014) F. Liu et al.   SCIENCE

Isomerization and Decomposition of a Criegee Intermediate in the Ozonolysis of Alkenes: Dynamics Using a Multireference Potential

(2013) Jaroslaw Kalinowski et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

UV spectroscopic characterization of an alkyl substituted Criegee intermediate CH3CHOO

(2013) Joseph M. Beames et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: Ultraviolet photodissociation dynamics of the simplest Criegee intermediate CH2OO

(2013) Julia H. Lehman et al.   JOURNAL OF CHEMICAL PHYSICS

The multigrid POTFIT (MGPF) method: Grid representations of potentials for quantum dynamics of large systems

(2013) Daniel Peláez et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: Determination of the molecular structure of the simplest Criegee intermediate CH2OO

(2013) Masakazu Nakajima et al.   JOURNAL OF CHEMICAL PHYSICS

Permutation invariant polynomial neural network approach to fitting potential energy surfaces. II. Four-atom systems

(2013) Jun Li et al.   JOURNAL OF CHEMICAL PHYSICS

Permutation invariant polynomial neural network approach to fitting potential energy surfaces

(2013) Bin Jiang et al.   JOURNAL OF CHEMICAL PHYSICS

Absolute Ultraviolet Absorption Spectrum of a Criegee Intermediate CH2OO

(2013) Leonid Sheps   Journal of Physical Chemistry Letters

The Simplest Criegee Intermediate (H2C═O–O): Isotopic Spectroscopy, Equilibrium Structure, and Possible Formation from Atmospheric Lightning

(2013) Michael C. McCarthy et al.   Journal of Physical Chemistry Letters

Criegee Intermediates React with Ozone

(2013) Henrik G. Kjaergaard et al.   Journal of Physical Chemistry Letters

Research frontiers in the chemistry of Criegee intermediates and tropospheric ozonolysis

(2013) Craig A. Taatjes et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Infrared Absorption Spectrum of the Simplest Criegee Intermediate CH2OO

(2013) Y.-T. Su et al.   SCIENCE

Direct Measurements of Conformer-Dependent Reactivity of the Criegee Intermediate CH3CHOO

(2013) C. A. Taatjes et al.   SCIENCE

Theoretical studies of atmospheric reaction mechanisms in the troposphere

(2012) Luc Vereecken et al.   CHEMICAL SOCIETY REVIEWS

Spectroscopy of the Simplest Criegee Intermediate CH2OO: Simulation of the First Bands in Its Electronic and Photoelectron Spectra

(2012) Edmond P. F. Lee et al.   CHEMISTRY-A EUROPEAN JOURNAL

Quantum approaches to polyatomic reaction dynamics

(2012) Gunnar Nyman et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

Automatic computer procedure for generating exact and analytical kinetic energy operators based on the polyspherical approach

(2012) Mamadou Ndong et al.   JOURNAL OF CHEMICAL PHYSICS

Ultraviolet Spectrum and Photochemistry of the Simplest Criegee Intermediate CH2OO

(2012) Joseph M. Beames et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Direct measurement of Criegee intermediate (CH2OO) reactions with acetone, acetaldehyde, and hexafluoroacetone

(2012) Craig A. Taatjes et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Direct Kinetic Measurements of Criegee Intermediate (CH2OO) Formed by Reaction of CH2I with O2

(2012) O. Welz et al.   SCIENCE

Theoretical studies of the tunneling splitting of malonaldehyde using the multiconfiguration time-dependent Hartree approach

(2011) Markus Schröder et al.   JOURNAL OF CHEMICAL PHYSICS

Effects of the substituents on the reactivity of carbonyl oxides. A theoretical study on the reaction of substituted carbonyl oxides with water

(2011) J. M. Anglada et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

A general rigorous quantum dynamics algorithm to calculate vibrational energy levels of pentaatomic molecules

(2009) Hua-Gen Yu   JOURNAL OF MOLECULAR SPECTROSCOPY

The gas-phase ozonolysis of unsaturated volatile organic compounds in the troposphere

(2008) David Johnson et al.   CHEMICAL SOCIETY REVIEWS

Direct Observation of the Gas-Phase Criegee Intermediate (CH2OO)

(2008) Craig A. Taatjes et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY