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Erik Deumens

Showing results (1-10 of 7) with videos related to

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The Journal of Physical Chemistry. A|March 26, 2014
Quantum nuclear extension of electron nuclear dynamics on folded effective-potential surfacesBenjamin Hall, Erik Deumens, Yngve Öhrn, et al.
Journal of Computational Chemistry|October 9, 2002
Integral algorithm and density matrix integration scheme for ab initio band structure calculations on polymeric systemsDenis Jacquemin, Benoît Champagne, Jean-Marie André, et al.
Frontiers in Chemistry|December 17, 2020
Application of Quantum Computing to Biochemical Systems: A Look to the FutureHai-Ping Cheng, Erik Deumens, James K Freericks, et al.
Journal of Computational Chemistry|February 14, 2008
A versatile AMBER-Gaussian QM/MM interface through PUPILJuan Torras, Gustavo de M Seabra, Erik Deumens, et al.
The Journal of Chemical Physics|June 15, 2007
Fracture, water dissociation, and proton conduction in SiO2 nanochainsChao Cao, Yao He, Juan Torras, et al.
Journal of Computational Chemistry|May 10, 2012
Comment on "A minimal implementation of the AMBER-GAUSSIAN interface for ab initio QM/MM-MD simulation"Benjamin P Roberts, Gustavo M Seabra, Adrian E Roitberg, et al.
Proceedings of Spie--The International Society for Optical Engineering|March 9, 2026
ComPRePS 2.0: Enabling Massive-Scale Distributed Computing on High-Performance Computing Cluster for Histopathological Data ProcessingSuhas Katari Chaluva Kumar, Anindya S Paul, Haitham Abdelazim, et al.
Pageof 1

Showing results (1-10 of 7) with videos related to

Sort By:
Pageof 1
The Journal of Physical Chemistry. A|March 26, 2014
Quantum nuclear extension of electron nuclear dynamics on folded effective-potential surfacesBenjamin Hall, Erik Deumens, Yngve Öhrn, et al.
Journal of Computational Chemistry|October 9, 2002
Integral algorithm and density matrix integration scheme for ab initio band structure calculations on polymeric systemsDenis Jacquemin, Benoît Champagne, Jean-Marie André, et al.
Frontiers in Chemistry|December 17, 2020
Application of Quantum Computing to Biochemical Systems: A Look to the FutureHai-Ping Cheng, Erik Deumens, James K Freericks, et al.
Journal of Computational Chemistry|February 14, 2008
A versatile AMBER-Gaussian QM/MM interface through PUPILJuan Torras, Gustavo de M Seabra, Erik Deumens, et al.
The Journal of Chemical Physics|June 15, 2007
Fracture, water dissociation, and proton conduction in SiO2 nanochainsChao Cao, Yao He, Juan Torras, et al.
Journal of Computational Chemistry|May 10, 2012
Comment on "A minimal implementation of the AMBER-GAUSSIAN interface for ab initio QM/MM-MD simulation"Benjamin P Roberts, Gustavo M Seabra, Adrian E Roitberg, et al.
Proceedings of Spie--The International Society for Optical Engineering|March 9, 2026
ComPRePS 2.0: Enabling Massive-Scale Distributed Computing on High-Performance Computing Cluster for Histopathological Data ProcessingSuhas Katari Chaluva Kumar, Anindya S Paul, Haitham Abdelazim, et al.
Pageof 1