Titus A. Beu - Publications, H-index & Citations

Ion transport through gated carbon nanotubes: Molecular dynamics simulations using polarizable water 通过门控碳纳米管的离子传输: 使用可极化水的分子动力学模拟

IF4.8

2022-09-28

PREAI

Terteci-Popescu, Andrada-Elena; Beu, Titus Adrian

JOURNAL OF MOLECULAR STRUCTURE

IF4.7

2021-12-01

PREAI

Ailenei, Andrada-Elena; Beu, Titus Adrian

Martini Force Field for Protonated Polyethyleneimine 质子化聚乙烯亚胺的马提尼力场

Light-induced spin transitions in Ni(II)-based macrocyclic-ligand complexes: A DFT study 基于Ni(II) 的大环配体配合物中的光诱导自旋跃迁: DFT研究

IF4.8

2019-11-25

PREAI

Beu, Titus Adrian; Ailenei, Andrada-Elena; Costinas, Razvan-Ioan

JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY

IF4.7

2019-05-01

PREAI

Farcas, Alex-Adrian; Beu, Titus A.; Bende, Attila

CHARMM force field for protonated polyethyleneimine

CHARMM force field and molecular dynamics simulations of protonated polyethylenimine 质子化聚乙烯亚胺的CHARMM力场和分子动力学模拟

IF4.8

2018-10-26

PREAI

Beu, Titus Adrian; Ailenei, Andrada-Elena; Farcas, Alexandra

The vapor-liquid interface potential of (multi)polar fluids and its influence on ion solvation

IF4.8

2017-07-27

PREAI

Beu, Titus Adrian; Farcas, Alexandra

GPU-accelerated computation of electron transfer

IF3.1

2013-04-15

OAAI

Horvath, Lorand; Beu, Titus; Manghi, Manoel; Palmeri, John

Simulation of the flow of aqueous solutions through carbon nanotubes 模拟水溶液通过碳纳米管的流动

IF4.8

2012-07-30

PREAI

Hoefinger, Siegfried; Acocella, Angela; Pop, Sergiu C.; Narumi, Tetsu; Yasuoka, Kenji; Beu, Titus; Zerbetto, Francesco

COMPUTER PHYSICS COMMUNICATIONS

IF3.4

2011-09-01

PREAI

Beu, Titus A.

Molecular dynamics simulations of ion transport through carbon nanotubes. II. Structural effects of the nanotube radius, solute concentration, and applied electric fields

Molecular dynamics simulations of ion transport through carbon nanotubes. III. Influence of the nanotube radius, solute concentration, and applied electric fields on the transport properties

IF3.1

2011-07-29

PREAI

Beu, Titus A.

Radiation-induced fragmentation of fullerenes

IF3.1

2011-07-29

PREAI

Beu, Titus A.

Molecular dynamics simulations of ion transport through carbon nanotubes. I. Influence of geometry, ion specificity, and many-body interactions

IF3.7

2011-01-25

PREAI

Beu, Titus A.; Jurjiu, Aurel

Tight-binding molecular dynamics simulations of radiation-induced C60 fragmentation

IF3.1

2010-04-28

PREAI

Beu, Titus A.

Tight-binding molecular dynamics simulations of radiation-induced fragmentation of C60

IF3.7

2009-02-26

PREAI

Beu, Titus A.; Horvath, Lorand; Ghisoiu, Ioan

First-principles calculations of the vibrational spectra of one-dimensional C60 polymers

IF3.7

2008-02-04

PREAI

Horvath, Lorand; Beu, Titus A.

Infrared spectroscopy of large ammonia clusters as a function of size

IF3.7

2006-11-20

PREAI

Beu, Titus A.; Onoe, Jun

First-principles calculations of the electronic structure of one-dimensional C60 polymers -: art. no. 155416

IF3.1

2006-10-03

PREAI

Steinbach, Christof; Buck, Udo; Beu, Titus A.

Intermolecular vibrations of large ammonia clusters from helium atom scattering

IF3.7

2005-10-18

PREAI

Beu, TA; Onoe, J; Hida, A

Vibrational spectra of ammonia clusters from n=3 to 18

IF3.1

2002-08-15

PREAI

Beu, TA; Steinbach, C; Buck, U