Schieber, N.

Authored

(139b) Understanding the Effect of Changing Complexities of Potential Energy Functions on the Entropic Contribution to Free Energy Differences of Organic Polymorphs
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(136c) Capturing the Role of Temperature and the Sensitivity to Energy Function Complexity in Crystal Polymorph Stability Using Molecular Modeling
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(192bf) Improved Thermal Gradient Quasiharmonic Approximations for Thermodynamic Properties of Organic Crystals with the Inclusion of Anisotropy
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(392b) Prediction of Solid State Phase Diagrams Using Multistate Reweighting and Jacobian Mapping
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(136d) Can Lattice Dynamics with Anisotropic and Isotropic Thermal Expansion Accurately Estimate Thermodynamic Properties of Crystals Pharmaceutics Compared to Molecular Dynamics?
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(192ag) Differences in Relative Free Energy Versus Temperature Curves for Small Organic Molecules  between Quantum Mechanical and Classical Potentials.
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(436i) Polymorphic Transformations at Ambient Conditions Elucidated with Molecular Dynamics
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)

Related Proceedings

2016 AIChE Annual Meeting2017 Annual Meeting2018 AIChE Annual Meeting