Publications List

 

2013

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Polymorphism in 4-Hydroxybenzaldehyde: A Crystal Packing and Thermodynamic Study

Cryst. Growth Des. 2013, 13, 2803−2814.

 

 

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All-Atom Force Field for Molecular Dynamics Simulations on Organotransition Metal Solids and Liquids. Application to M(CO)n (M = Cr, Fe, Ni, Mo, Ru, or W) Compounds

J. Phys. Chem. A 2017, 118, 11107−11113.
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Energetics and Structure of Simvastatin

Mol. Pharmaceutics 2013, 10, 2713−2722.

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Nano-segregation in Ionic Liquids: Scorpions and Vanishing Chains

Phys. Chem. Chem. Phys. 2013, 15, 16256-16262.

 

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High Ionicity Ionic Liquids (HIILs): Comparing the Effect of Ethylsulfonate and Ethylsulfate Anions

Phys. Chem. Chem. Phys.. 2013, 15, 18138-18147.

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