A wealth of structural and dynamical information has been obtained in the last 30 years from
the study of high-resolution spectra of molecular clusters generated in a cold supersonic …

The pgopher program is a general purpose program for simulating and fitting molecular
spectra, particularly the rotational structure. The current version can handle linear …

The computer simulation of condensed systems is a challenging task. While electronic
structure methods like density-functional theory (DFT) usually provide a good compromise …

Broadband chirped-pulse Fourier transform microwave (CP-FTMW) spectrometers have
increased the sensitivity for molecular rotational spectroscopy. The measurement dynamic …

broadband microwave spectroscopy is a proven tool to precisely determine molecular
properties of gas-phase molecules. Recent developments make it applicable to investigate …

A combination of infrared multiple-photon dissociation (IRMPD) action spectroscopy and
quantum chemical calculations was employed to investigate the [M, C, 2H]+(M= Ru and Rh) …

An initial implementation of a tool for automatic assignment of spectra within the PGOPHER
program is presented, together with its application to rotational analysis of the ν11 band of …

Two new tools for computer assisted assignment of rotational spectra with the PGOPHER
program are presented, aimed particularly at spectra where many individual lines are …

Quantum mechanics builds large-scale graphs (networks): the vertices are the discrete
energy levels the quantum system possesses, and the edges are the (quantum …

High-resolution electronic spectra of indole (C8H7N) and their detailed analysis are
reported. Thirteen low-lying vibronic bands—from the electronic origin transition at 35231.4 …