Multiscale time-dependent density functional theory: Demonstration for plasmons
Jiang, Jiajian, Abi Mansour, Andrew, Ortoleva, Peter J
Published in The Journal of chemical physics (07.08.2017)
Published in The Journal of chemical physics (07.08.2017)
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Journal Article
Alternating Metastable/Stable Pattern in the Mercuric Iodide Crystal Formation Outside the Ostwald Rule of Stages
Ayass, Mahmoud M, Abi Mansour, Andrew, Al-Ghoul, Mazen
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (11.09.2014)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (11.09.2014)
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Journal Article
Prospective on multiscale simulation of virus-like particles: Application to computer-aided vaccine design
Mansour, Andrew Abi, Sereda, Yuriy V, Yang, Jing, Ortoleva, Peter J
Published in Vaccine (04.11.2015)
Published in Vaccine (04.11.2015)
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Multiscale Factorization Method for Simulating Mesoscopic Systems with Atomic Precision
Abi Mansour, Andrew, Ortoleva, Peter J
Published in Journal of chemical theory and computation (11.02.2014)
Published in Journal of chemical theory and computation (11.02.2014)
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ProtoMD: A prototyping toolkit for multiscale molecular dynamics
Somogyi, Endre, Mansour, Andrew Abi, Ortoleva, Peter J.
Published in Computer physics communications (01.05.2016)
Published in Computer physics communications (01.05.2016)
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Multiscale Molecular Dynamics Approach to Energy Transfer in Nanomaterials
Espinosa-Duran, John M, Sereda, Yuriy V, Abi-Mansour, Andrew, Ortoleva, Peter
Published in Journal of chemical theory and computation (13.02.2018)
Published in Journal of chemical theory and computation (13.02.2018)
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