Quantum dynamics in molecular systems

被引：0

作者：

Ancarani, Lorenzo Ugo ^{[1
]}

Agostini, Federica ^{[2
]}

Lepers, Maxence ^{[3
]}

机构：

[1] Univ Lorraine, CNRS, UMR 7019, Lab Phys & Chim Theor, 1 Bd Arago,BP 95823, F-57078 Metz 3, France

[2] Univ Paris Saclay, CNRS, UMR 8000, Inst Chim Phys, F-91405 Orsay, France

[3] Univ Bourgogne Franche Comte, CNRS, UMR 6303, Lab Interdisciplinaire Carnot Bourgogne, Batiment Mirande,9 Ave Alain Savary, BP 47870, F-21078 Dijon, France

来源：

EUROPEAN PHYSICAL JOURNAL-SPECIAL TOPICS | 2023年

关键词：

D O I：

暂无

中图分类号：

O4 [物理学];

学科分类号：

0702 ;

摘要：

引用

页数：3

共 50 条

[11] Molecular dynamics with quantum forces: Vibrational spectra of localized systems [J].

Chelikowsky, J. R. ;

Jing, X. ;

Wu, K. ;

Saad, Y. .

Physical Review B: Condensed Matter, 53 (18)

[12] Coupling Molecular Systems with Plasmonic Nanocavities: A Quantum Dynamics Approach [J].

Jamshidi, Zahra ;

Kargar, Kimia ;

Mendive-Tapia, David ;

Vendrell, Oriol .

JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2023, 14 (50) :11367-11375

[13] Molecular dynamics of large systems with quantum corrections for selected nuclei [J].

Garashchuk, Sophya .

ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253

[14] Quantum dynamics of bio-molecular systems in noisy environments [J].

Huelga, S. F. ;

Plenio, M. B. .

22ND SOLVAY CONFERENCE ON CHEMISTRY: QUANTUM EFFECTS IN CHEMISTRY AND BIOLOGY, 2011, 3 (01)

[15] Quantum Wavepacket Ab Initio Molecular Dynamics for Extended Systems [J].

Li, Xiaohu ;

Iyengar, Srinivasan S. .

JOURNAL OF PHYSICAL CHEMISTRY A, 2011, 115 (23) :6269-6284

[16] Exact quantum dynamics developments for floppy molecular systems and complexes [J].

Matyus, Edit ;

Santa Daria, Alberto Martin ;

Avila, Gustavo .

CHEMICAL COMMUNICATIONS, 2023, 59 (04) :366-381

[17] Mixed quantum/classical dynamics of nuclei in large molecular systems [J].

Garashchuk, Sophya .

ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 243

[18] Molecular Dynamics Workflow Decomposition for Hybrid Classic/Quantum Systems [J].

Cranganore, Sandeep Suresh ;

De Maio, Vincenzo ;

Brandic, Ivona ;

Tu Mai Anh Do ;

Deelman, Ewa .

2022 IEEE 18TH INTERNATIONAL CONFERENCE ON E-SCIENCE (ESCIENCE 2022), 2022, :346-356

[19] Quantum Molecular Dynamics [J].

Ritchie, Burke .

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2011, 111 (01) :1-7

[20] Parallel version of a Quantum Classical Molecular Dynamics code for complex molecular and biomolecular systems [J].

Bala, P ;

Clark, T ;

Grochowski, P ;

Lesyng, B ;

McCammon, JA .

RECENT ADVANCES IN PARALLEL VIRTUAL MACHINE AND MESSAGE PASSING INTERFACE, 1997, 1332 :409-416

← 1 2 3 4 5 →