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Lista de obras de Laura K McKemmish

A unified diabatic description for electron transfer reactions, isomerization reactions, proton transfer reactions, and aromaticity

artículo científico publicado en 2015

Accurate Electron Densities at Nuclei Using Small Ramp-Gaussian Basis Sets

artículo científico publicado en 2015

Bond angle variations in XH3 [X = N, P, As, Sb, Bi]: the critical role of Rydberg orbitals exposed using a diabatic state model

artículo científico publicado en 2015

Bringing pupils into the ORBYTS of research

Diabatic models with transferrable parameters for generalized chemical reactions

artículo científico publicado en 2017

Efficient calculation of integrals in mixed ramp-Gaussian basis sets

artículo científico publicado en 2015

Electron-vibration entanglement in the Born-Oppenheimer description of chemical reactions and spectroscopy

artículo científico publicado en 2015

ExoMol molecular line lists – XXVI: spectra of SH and NS

artículo científico publicado en 2018

Experimental energy levels of 12C14N through marvel analysis

artículo científico publicado en 2020

Frequency-based Quantum Computers from a Chemist's Perspective

Fundamentals: general discussion

artículo científico publicado en 2016

Gaussian Expansions of Orbitals

artículo científico publicado en 2012

General mathematical formulation of scattering processes in atom-diatomic collisions in the RmatReact methodology

scientific article published on 05 August 2019

Low-temperature chemistry using the R-matrix method ⬇️

scientific article published on 01 December 2016

Mixed Ramp–Gaussian Basis Sets

artículo científico publicado en 2014

Non-adiabatic effects in thermochemistry, spectroscopy and kinetics: the general importance of all three Born-Oppenheimer breakdown corrections

artículo científico publicado en 2015

Non-adiabatic reactions: general discussion

artículo científico publicado en 2016

Original Research By Young Twinkle Students (ORBYTS): when can students start performing original research?

Penrose-Hameroff orchestrated objective-reduction proposal for human consciousness is not biologically feasible

artículo científico publicado en 2009

Phys FilmMakers: teaching science students how to make YouTube-style videos

scholarly article by Rebecca L Coates et al published 19 December 2017 in European Journal of Physics

Quantum entanglement between electronic and vibrational degrees of freedom in molecules

article

The nature of electron correlation in a dissociating bond

scientific article published on 01 June 2011

The revised Penrose-Hameroff orchestrated objective-reduction proposal for human consciousness is not scientifically justified: comment on "Consciousness in the universe: a review of the 'Orch OR' theory" by Hameroff and Penrose

artículo científico publicado en 2013

Theab initiocalculation of spectra of open shell diatomic molecules ⬇️

VIBFREQ1295: A New Database for Vibrational Frequency Calculations

artículo científico publicado en 2022

Weak, strong, and coherent regimes of Fröhlich condensation and their applications to terahertz medicine and quantum consciousness

artículo científico publicado en 2009

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