Works matching AU Germann, Timothy C

Results: 19

Crack nucleation at forging flaws studied by non-local peridynamics simulations.

Published in:

Mathematics & Mechanics of Solids, 2022, v. 27, n. 6, p. 1129, doi. 10.1177/10812865211057211

By:

Rezaul Karim, Mohammad;
Kadau, Kai;
Narasimhachary, Santosh;
Radaelli, Francesco;
Amann, Christian;
Dayal, Kaushik;
Silling, Stewart;
Germann, Timothy C.

Publication type:

Article

Dislocation Structure behind a Shock Front in Fcc Perfect Crystals: Atomistic Simulation Results.

Published in:

Metallurgical & Materials Transactions. Part A, 2004, v. 35, n. 9, p. 2609, doi. 10.1007/s11661-004-0206-5

By:

Germann, Timothy C.;
Holian, Brad Lee;
Lomdahl, Peter S.;
Mareschal, Michel;
Tanguy, Dome;
Ravelo, Ramon

Publication type:

Article

Surface Electrochemical Stability and Strain‐Tunable Lithium Storage of Highly Flexible 2D Transition Metal Carbides.

Published in:

Advanced Functional Materials, 2018, v. 28, n. 44, p. N.PAG, doi. 10.1002/adfm.201804867

By:

Chen, Shu;
Fu, Zhongheng;
Zhang, Hang;
Legut, Dominik;
Germann, Timothy C.;
Zhang, Qianfan;
Du, Shiyu;
Francisco, Joseph S.;
Zhang, Ruifeng

Publication type:

Article

369 Tflop/s molecular dynamics simulations on the petaflop hybrid supercomputer ‘Roadrunner’.

Published in:

Concurrency & Computation: Practice & Experience, 2009, v. 21, n. 17, p. 2143

By:

Germann, Timothy C.;
Kadau, Kai;
Swaminarayan, Sriram

Publication type:

Article

TRILLION-ATOM MOLECULAR DYNAMICS BECOMES A REALITY.

Published in:

International Journal of Modern Physics C: Computational Physics & Physical Computation, 2008, v. 19, n. 9, p. 1315, doi. 10.1142/S0129183108012911

By:

GERMANN, TIMOTHY C.;
KADAU, KAI

Publication type:

Article

MOLECULAR DYNAMICS COMES OF AGE:: 320 BILLION ATOM SIMULATION ON BlueGene/L.

Published in:

International Journal of Modern Physics C: Computational Physics & Physical Computation, 2006, v. 17, n. 12, p. 1755, doi. 10.1142/S0129183106010182

By:

KADAU, KAI;
GERMANN, TIMOTHY C.;
LOMDAHL, PETER S.

Publication type:

Article

LARGE-SCALE MOLECULAR-DYNAMICS SIMULATION OF 19 BILLION PARTICLES.

Published in:

International Journal of Modern Physics C: Computational Physics & Physical Computation, 2004, v. 15, n. 1, p. 193, doi. 10.1142/S0129183104005590

By:

Kadau, Kai;
Germann, Timothy C.;
Lomdahl, Peter S.

Publication type:

Article

ECP libraries and tools: An overview.

Published in:

International Journal of High Performance Computing Applications, 2024, v. 38, n. 5, p. 381, doi. 10.1177/10943420241271005

By:

Heroux, Michael A;
McInnes, Lois Curfman;
Ahrens, James;
Gamblin, Todd;
Germann, Timothy C;
Li, Xiaoye Sherry;
Mohror, Kathryn;
Munson, Todd;
Shende, Sameer;
Thakur, Rajeev;
Vetter, Jeffrey;
Willenbring, James

Publication type:

Article

A survey of software implementations used by application codes in the Exascale Computing Project.

Published in:

International Journal of High Performance Computing Applications, 2022, v. 36, n. 1, p. 5, doi. 10.1177/10943420211028940

By:

Evans, Thomas M;
Siegel, Andrew;
Draeger, Erik W;
Deslippe, Jack;
Francois, Marianne M;
Germann, Timothy C;
Hart, William E;
Martin, Daniel F

Publication type:

Article

Co-design in the Exascale Computing Project.

Published in:

International Journal of High Performance Computing Applications, 2021, v. 35, n. 6, p. 503, doi. 10.1177/10943420211059380

By:

Germann, Timothy C

Publication type:

Article

Rational Design of Highly Stable and Active MXene‐Based Bifunctional ORR/OER Double‐Atom Catalysts.

Published in:

Advanced Materials, 2021, v. 33, n. 40, p. 1, doi. 10.1002/adma.202102595

By:

Wei, Bo;
Fu, Zhongheng;
Legut, Dominik;
Germann, Timothy C.;
Du, Shiyu;
Zhang, Haijun;
Francisco, Joseph S.;
Zhang, Ruifeng

Publication type:

Article

Encapsulation kinetics and dynamics of carbon monoxide in clathrate hydrate.

Published in:

Nature Communications, 2014, v. 5, n. 6, p. 4128, doi. 10.1038/ncomms5128

By:

Zhu, Jinlong;
Du, Shiyu;
Yu, Xiaohui;
Zhang, Jianzhong;
Xu, Hongwu;
Vogel, Sven C.;
Germann, Timothy C.;
Francisco, Joseph S.;
Izumi, Fujio;
Momma, Koichi;
Kawamura, Yukihiko;
Jin, Changqing;
Zhao, Yusheng

Publication type:

Article

Predictive scale-bridging simulations through active learning.

Published in:

Scientific Reports, 2023, v. 13, n. 1, p. 1, doi. 10.1038/s41598-023-42823-6

By:

Karra, Satish;
Mehana, Mohamed;
Lubbers, Nicholas;
Chen, Yu;
Diaw, Abdourahmane;
Santos, Javier E.;
Pachalieva, Aleksandra;
Pavel, Robert S.;
Haack, Jeffrey R.;
McKerns, Michael;
Junghans, Christoph;
Kang, Qinjun;
Livescu, Daniel;
Germann, Timothy C.;
Viswanathan, Hari S.

Publication type:

Article

Predictive scale-bridging simulations through active learning.

Published in:

Scientific Reports, 2023, v. 13, n. 1, p. 1, doi. 10.1038/s41598-023-42823-6

By:

Karra, Satish;
Mehana, Mohamed;
Lubbers, Nicholas;
Chen, Yu;
Diaw, Abdourahmane;
Santos, Javier E.;
Pachalieva, Aleksandra;
Pavel, Robert S.;
Haack, Jeffrey R.;
McKerns, Michael;
Junghans, Christoph;
Kang, Qinjun;
Livescu, Daniel;
Germann, Timothy C.;
Viswanathan, Hari S.

Publication type:

Article

The basic matrix library (BML) for quantum chemistry.

Published in:

Journal of Supercomputing, 2018, v. 74, n. 11, p. 6201, doi. 10.1007/s11227-018-2533-0

By:

Bock, Nicolas;
Negre, Christian F. A.;
Mniszewski, Susan M.;
Mohd-Yusof, Jamaludin;
Aradi, Bálint;
Fattebert, Jean-Luc;
Osei-Kuffuor, Daniel;
Germann, Timothy C.;
Niklasson, Anders M. N.

Publication type:

Article

High pressure suppression of plasticity due to an overabundance of shear embryo formation.

Published in:

NPJ Computational Materials, 2024, v. 10, n. 1, p. 1, doi. 10.1038/s41524-024-01348-w

By:

Hamilton, Brenden W.;
Germann, Timothy C.

Publication type:

Article

Modeling and scale-bridging using machine learning: nanoconfinement effects in porous media.

Published in:

Scientific Reports, 2020, v. 10, n. 1, p. 1, doi. 10.1038/s41598-020-69661-0

By:

Lubbers, Nicholas;
Agarwal, Animesh;
Chen, Yu;
Son, Soyoun;
Mehana, Mohamed;
Kang, Qinjun;
Karra, Satish;
Junghans, Christoph;
Germann, Timothy C.;
Viswanathan, Hari S.

Publication type:

Article

Cost effectiveness of preemptive school closures to mitigate pandemic influenza outbreaks of differing severity in the United States.

Published in:

BMC Public Health, 2024, v. 24, n. 1, p. 1, doi. 10.1186/s12889-023-17469-8

By:

Dauelsberg, Lori R.;
Maskery, Brian;
Joo, Heesoo;
Germann, Timothy C.;
Del Valle, Sara Y.;
Uzicanin, Amra

Publication type:

Article

Pore‐Scale Modeling of Carbon Dioxide and Hydrogen Transport During Geologic Gas Storage.

Published in:

Geophysical Research Letters, 2024, v. 51, n. 12, p. 1, doi. 10.1029/2024GL109216

By:

Purswani, Prakash;
Guiltinan, Eric J.;
Chen, Yu;
Kang, Qinjun;
Mehana, Mohamed Z.;
Neil, Chelsea W.;
Germann, Timothy C.;
Gross, Michael R.

Publication type:

Article