deJong, Wibe A.: search on Z-Library

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1

Comparison of Cluster, Slab, and Analytic Potential Models for the Dimethyl Methylphosphonate (DMMP)/TiO 2 (110) Intermolecular Interaction

Yang, Li, Tunega, Daniel, Xu, Lai, Govind, Niranjan, Sun, Rui, Taylor, Ramona, Lischka, Hans, DeJong, Wibe A., Hase, William L.

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 2.82 MB

english, 2013

2

Cluster-Models for Uranyl(VI) Adsorption on α-Alumina

Glezakou, Vassiliki-Alexandra, deJong, Wibe A.

Journal:

Journal of Physical Chemistry A

Year:

2011

Language:

english

File:

PDF, 1.62 MB

english, 2011

3

ions

Ilton, Eugene S., deJong, Wibe A., Bagus, Paul S.

Journal:

Physical Review B

Year:

2003

Language:

english

File:

PDF, 110 KB

english, 2003

4

Dynamic polarizabilities of polyaromatic hydrocarbons using coupled-cluster linear response theory

Hammond, Jeff R., Kowalski, Karol, deJong, Wibe A.

Journal:

The Journal of Chemical Physics

Year:

2007

Language:

english

File:

PDF, 515 KB

english, 2007

5

[ACM Press the Conference - Portland, Oregon (2009.11.14-2009.11.20)] Proceedings of the Conference on High Performance Computing Networking, Storage and Analysis - SC '09 - Liquid water

Aprà, Edoardo, Rendell, Alistair P., Harrison, Robert J., Tipparaju, Vinod, deJong, Wibe A., Xantheas, Sotiris S.

Year:

2009

Language:

english

File:

PDF, 252 KB

english, 2009

6

A Direct Dynamics Trajectory Study of F - + CH 3 OOH Reactive Collisions Reveals a Major Non-IRC Reaction Path

López, José G., Vayner, Grigoriy, Lourderaj, Upakarasamy, Addepalli, Srirangam V., Kato, Shuji, deJong, Wibe A., Windus, Theresa L., Hase, William L.

Journal:

Journal of the American Chemical Society

Year:

2007

Language:

english

File:

PDF, 299 KB

english, 2007

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