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- 2006
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Mark
Comparison of overlap-based models for approximating the exchange-repulsion energy
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- Contribution to journal › Article
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Origin invariant approaches to the calculation of two-photon circular dichroism
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- Contribution to journal › Article
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Mark
Conformational disorder of conjugated polymers
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- Contribution to journal › Article
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Mark
Implicit versus explicit solvent in free energy calculations of enzyme catalysis: Methyl transfer catalyzed by catechol O-methyltransferase
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- Contribution to journal › Article
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Mark
The electronic structure of iron phthalocyanine probed by photoelectron and x-ray absorption spectroscopies and density functional theory calculations
(
- Contribution to journal › Article
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Mark
Fast noniterative orbital localization for large molecules
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- Contribution to journal › Article
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Mark
Picosecond calorimetry : time-resolved x-ray diffraction studies of liquid CH2Cl2
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- Contribution to journal › Article
- 2005
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Mark
Photon energy dependence of fragmentation of small argon clusters
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- Contribution to journal › Article
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Mark
A 1 : 1 complex between a hydroxyl radical and ozone
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- Contribution to journal › Letter
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Mark
Electronic structure of a vapor-deposited metal-free phthalocyanine thin film
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- Contribution to journal › Article