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Researcher

John De Vos

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2 Results

2023

Capturing correlation in the spin frustrated H3-ring using the generator coordinate method and spin-constrained generalised Hartree-Fock states

Xeno De VriendtJohn De VosStijn De BaerdemackerPatrick BultinckGuillaume Acke

A2 Journal Article in MOLECULAR PHYSICS

2023

Comprehensive quantum chemical analysis of the (ro)vibrational spectrum of thiirane and its deuterated isotopologue

John De VosBenjamin SchröderGuntram Rauhut

A1 Journal Article in SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

2023