Cp2K

cp2k timeline 02:59
cp2k timeline Alin Marin Elena 1,661 13 лет назад
Perform Molecular Dynamics Using CP2K on Rescale 04:44
Perform Molecular Dynamics Using CP2K on Rescale Rescale, Inc. 527 2 года назад
CP2K High Performance Computing in Chemistry and Material Science 03:04
CP2K High Performance Computing in Chemistry and Material Science PASC Conference 356 3 года назад
Submatrix Method in CP2K (SC'20 paper) 20:01
Submatrix Method in CP2K (SC'20 paper) HPC Research Group 155 4 года назад
Introduction to CP2K (1/7) - Gaussian and Plane Waves Method (prof. Jürg Hutter) 01:26:41
Introduction to CP2K (1/7) - Gaussian and Plane Waves Method (prof. Jürg Hutter) HPC-UGent 16,128 6 лет назад
Liquid water ab initio molecular dynamics 01:20
Liquid water ab initio molecular dynamics Massimo 46,412 10 лет назад
CP2K's Parallel Algorithms Overview, Joost VandeVondele (2009) 01:01:35
CP2K's Parallel Algorithms Overview, Joost VandeVondele (2009) CP2K 294 4 года назад
ARCHER Webinar : CP2K - Recent performance improvements and new TD-DFT functionality 54:58
ARCHER Webinar : CP2K - Recent performance improvements and new TD-DFT functionality ARCHER UK National Supercomputing Service 2,099 8 лет назад
Submatrix Method in CP2K (SC'20 paper) 20:01
Submatrix Method in CP2K (SC'20 paper) Paderborn Center for Parallel Computing 102 3 года назад
BioExcel Webinar #51: Multiscale QM/MM: exploring chemical reactions using GROMACS/CP2K interface 51:29
BioExcel Webinar #51: Multiscale QM/MM: exploring chemical reactions using GROMACS/CP2K interface BioExcel CoE 2,074 4 года назад
CP2K/QuickStep: The Swiss Army Knife of Simulation 25:14
CP2K/QuickStep: The Swiss Army Knife of Simulation Paderborn Center for Parallel Computing 1,006 3 года назад
Accelerated Sparse Matrix Multiplication for Quantum Chemistry with CP2K on Hybrid Supercomputers 21:43
Accelerated Sparse Matrix Multiplication for Quantum Chemistry with CP2K on Hybrid Supercomputers insideHPC Report 724 10 лет назад
Petascale resources and CP2K, Joost VandeVondele (ETH Zurich) 57:26
Petascale resources and CP2K, Joost VandeVondele (ETH Zurich) cscsch 2,248 10 лет назад
CP2K Tutorial: 1.0 CP2K installation, introduction (summary of different methods, linux) 06:07
CP2K Tutorial: 1.0 CP2K installation, introduction (summary of different methods, linux) QuantumNerd 7,384 4 года назад
QM/MM with GROMACS+CP2K - Practical 3 35:57
QM/MM with GROMACS+CP2K - Practical 3 BioExcel CoE 1,348 3 года назад
Energy Units Converter #computationalchemistry #machinelearning #vasp #particle #freeenergy 01:00
Energy Units Converter #computationalchemistry #machinelearning #vasp #particle #freeenergy DB Infotech 526 1 год назад
Basis set for f block elements #computationalchemistry #machinelearning #vasp #dft 01:00
Basis set for f block elements #computationalchemistry #machinelearning #vasp #dft DB Infotech 421 1 год назад
Install cp2k v8.2.0 psmp as normal user 04:32
Install cp2k v8.2.0 psmp as normal user Abbott Wang 550 3 года назад
QM/MM with GROMACS+CP2K - Q&A 1 14:56
QM/MM with GROMACS+CP2K - Q&A 1 BioExcel CoE 1,217 3 года назад
HPC libraries for CP2K and other electronic structure codes 01:01:17
HPC libraries for CP2K and other electronic structure codes MaX Centre of Excellence 964 4 года назад

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