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Structural and electronic properties of doped oligothiophenes in the presence of p-toluenesulfonate acids
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The mechanism of CO2 insertion into iridium(I) hydroxide and alkoxide bonds : a kinetics and computational study
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What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the pi-accepting abilities of N-heterocyclic carbenes?
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- Journal Article
- A1
- open access
Ab initio based thermal property predictions at a low cost : an error analysis
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- Journal Article
- A1
- open access
Error estimates for solid-state density-functional theory predictions: an overview by means of the ground-state elemental crystals
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Exploring the vibrational fingerprint of the electronic excitation energy via molecular dynamics
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Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
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Solution enthalpy of Po and Te in solid lead-bismuth eutectic
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Strontium mono-chloride : a new molecule for the determination of chlorine using high-resolution graphite furnace molecular absorption spectrometry and direct solid sample analysis
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Strength by joining methods: combining synthesis with NMR, IR, and vibrational circular dichroism spectroscopy for the determination of the relative configuration in hemicalide