Laura McKemmish

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Senior Lecturer

University of New South Wales

Australia

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About

Laura McKemmish is a Senior Lecturer at the University of New South Wales, Australia. Her research primarily focuses on high-resolution studies of exoplanets and thermochemistry calculations, as evidenced by her recent contributions to the ExoMol database and investigations of molecular line lists. Dr. McKemmish's work emphasizes the importance of accurate basis sets in density functional theory and explores the atmospheric phenomena of exoplanets.

Recent Grants

Grant: Close

Rmat3, developing new theoretical methodologies for treating ultracold atom-diatomic non-reactive and reactive collisions over deep potential wells.

Open Date: 2016-07-01

Close Date: 2017-12-01

Articles (17)

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2020

Collaborators (5)

Jonathan Tennyson

Massey Professor of Phyics

University College London

UNITED KINGDOM

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Heather Knutson

Professor

California Institute of Technology

UNITED STATES

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Victoria Clark

University College London

UNITED KINGDOM

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Charles Bowesman

University College London

UNITED KINGDOM

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MAIRE GORMAN

University of Sussex

UNITED KINGDOM

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Laura McKemmish

Research Interests

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About

Recent Grants

Articles (17)

Reply to Comment on “Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be Avoided”

Full spectroscopic model and trihybrid experimental-perturbative-variational line list for NH

ExoMol line lists – LV: hyperfine-resolved molecular line list for vanadium monoxide (51V16O)

A hybrid approach to generating diatomic line lists for high resolution studies of exoplanets and other hot astronomical objects: updates to ExoMol MgO, TiO, and VO line lists

Quartz Clouds in the Dayside Atmosphere of the Quintessential Hot Jupiter HD 189733 b

The 2024 release of the ExoMol database: Molecular line lists for exoplanet and other hot atmospheres

On the specialization of Gaussian basis sets for core-dependent properties

Full spectroscopic model and trihybrid experimental-perturbative-variational line list for ZrO

High-throughput quantum chemistry: empowering the search for molecular candidates behind unknown spectral signatures in exoplanetary atmospheres

Model Chemistry Recommendations for Scaled Harmonic Frequency Calculations: A Benchmark Study

Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be Avoided

VIBFREQ1295: A New Database for Vibrational Frequency Calculations

Meta‐analysis of uniform scaling factors for harmonic frequency calculations

Molecular diatomic spectroscopy data

Introducing Pseudoramps and Mixed Ramp-Gaussian Jensen Basis Sets for Better Nuclear Densities

Full spectroscopic model and trihybrid experimental-perturbative-variational line list for CN

The 2020 release of the ExoMol database: Molecular line lists for exoplanet and other hot atmospheres

Collaborators (5)

Jonathan Tennyson

Heather Knutson

Victoria Clark

Charles Bowesman

MAIRE GORMAN

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