Computational Chemistry
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- 2020
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Mark
Quantum refinement with multiple conformations : Application to the P-cluster in nitrogenase
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- Contribution to journal › Article
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Generalized Moment Correction for Long-Ranged Electrostatics
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- Contribution to journal › Article
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Mark
Dalton Project : A Python platform for molecular- and electronic-structure simulations of complex systems
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- Contribution to journal › Article
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Mark
Modern quantum chemistry with [Open]Molcas
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- Contribution to journal › Article
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Mark
Grand canonical simulations of ions between charged conducting surfaces using exact 3D Ewald summations
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- Contribution to journal › Article
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Mark
Automated orientation of water molecules in neutron crystallographic structures of proteins
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- Contribution to journal › Article
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Mark
Structural biology of calcium phosphate nanoclusters sequestered by phosphoproteins
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- Contribution to journal › Scientific review
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Strong-coupling theory of counterions with hard cores between symmetrically charged walls
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- Contribution to journal › Article
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A Stable Homoleptic Organometallic Iron(IV) Complex
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- Contribution to journal › Article
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Mark
Interactions in aqueous salt solutions : Atomistic modelling versus experiment
2020)(
- Thesis › Licentiate thesis