The recent development of a range of new methods for producing samples of gas-phase
molecules that are translationally cold (K) or ultracold (mK) is driving efforts to study reactive …

The detailed description of chemical reaction rates is embodied in transition state theory
(TST), now recognized as one of the great achievements of theoretical chemistry. TST …

Technical details of a new global mapping technique for finding equilibrium (EQ) and
transition structures (TS) on potential energy surfaces (PES), the scaled hypersphere search …

Formaldehyde, HCHO, is the highest-volume carbonyl in the atmosphere. It absorbs sunlight
at wavelengths shorter than 330 nm and photolyses to form H and HCO radicals, which then …

The roaming chemical reaction mechanism involves near-dissociation of an energized
molecule to radicals that leads instead to intramolecular reaction after reorientation at long …

Full-dimensional, three-state, surface hopping calculations of the photodissociation
dynamics of formaldehyde are reported on ab initio potential energy surfaces (PESs) for …

Formaldehyde is a major indoor air pollutant and can cause serious health disorders in
residents. This work reports the removal of formaldehyde from gas streams via alumina …

We present a detailed experimental and theoretical investigation of formaldehyde
photodissociation to H 2 and CO following excitation to the 2 1 4 1 and 2 1 4 3 transitions in …

Photodissociation of Simple Molecules in the Gas Phase | Chemical Reviews ACS ACS
Publications C&EN CAS Find my institution Log In Chemical Reviews ACS Publications. Most …

We review the photodissociation dynamics of formaldehyde with an emphasis on recent
calculations that make use of a global ab initio-based potential energy surface for the S0 …