Optimal clustering for quantum refinement of biomolecular structures: Q| R# 4
Title: Optimal clustering for quantum refinement of biomolecular structures: Q| R# 4 Authors: Y Wang, H Kruse, NW Moriarty, MP ...
Secondary ionization of pyrimidine nucleobases and their microhydrated derivatives in helium nanodroplets
Title: Secondary ionization of pyrimidine nucleobases and their microhydrated derivatives in helium nanodroplets Authors: JD Asmussen, AR Abid, A Sundaralingam, ...
Family of Gaussian wavepacket dynamics methods from the perspective of a nonlinear Schr” odinger equation”
Title: Family of Gaussian wavepacket dynamics methods from the perspective of a nonlinear Schr" odinger equation" Authors: J Vaníček DOI: ...
Imaging the photodissociation dynamics of internally excited ethyl radicals from high Rydberg states
Title: Imaging the photodissociation dynamics of internally excited ethyl radicals from high Rydberg states Authors: ...
Computational investigations of stable multiple-cage-occupancy He clathrate-like hydrostructures
Title: Computational investigations of stable multiple-cage-occupancy He clathrate-like hydrostructures Authors: R Yanes-Rodríguez, R Prosmiti DOI: https://pubs.rsc.org/en/content/articlehtml/2023/cp/d3cp00603d Date: 2023-09-14 21:26:44 Working ...
An ab initio study of the photodissociation of CH 2 I and CH 2 I+
Title: An ab initio study of the photodissociation of CH2I and CH2I+ Authors: A. Bouallagui, A. Zanchet, L. Bañares and A. García-Vela DOI: https://pubs.rsc.org/en/content/articlehtml/2023/cp/d3cp01460f ...
Structure and formation of copper cluster ions in multiply charged He nanodroplets
Title: Structure and formation of copper cluster ions in multiply charged He nanodroplets Authors: OV Lushchikova, M Gatchell, J Reichegger, ...
Fine Tuning the Intermolecular Interactions of Water Clusters Using the Dispersion-Corrected Density Functional Theory
Title: Fine Tuning the Intermolecular Interactions of Water Clusters Using the Dispersion-Corrected Density Functional Theory Authors: A Ferretti, L Canal, ...
A COMPUTATIONAL INSIGHT ON AU-BASED NANOALLOYS
Title: A COMPUTATIONAL INSIGHT ON AU-BASED NANOALLOYS Authors: MV Vanzan, S Zinzani, RM Jones, F Baletto DOI: https://www.mrs-mexico.org.mx/imrc2023/system/app_abstract-pdf.php?id_res=01144 Date: 2023-09-14 ...
Quantum Computations in Heavy Noble-Gas Hydride Cations: Reference Energies and New Spectroscopic Data
Title: Quantum Computations in Heavy Noble-Gas Hydride Cations: Reference Energies and New Spectroscopic Data Authors: MJ Montes de Oca-Estévez, R ...
