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Joint MCC-UKCP-EPCC Workshop on Ab initio Periodic Codes

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Agenda Day 1 - 19/01/2016

1200 - 1300
Registration
1300 - 1315
Introduction
1315 - 1345
CP2K: Advanced Overview
1345 - 1415
ONETEP: Advanced Overview
1415 - 1445
CRYSTAL: Advanced Overview
1445 - 1515
Coffee Break
1515 - 1545
CASTEP: Advanced Overview
1545 - 1615
VASP: Advanced Overview
1615 - 1645
Quantum Espresso: Advanced Overview
1645 - 1715
ARCHER: Overview
1715 - 1815
Poster Session
1820 - 1900
Coach Transfer to Hotel

Agenda Day 2 - 20/01/2016

0830 - 0915
Coach Transfer from Hotel
0915 - 0930
Quantum Espresso: Introduction to Tutorials
0930 - 0945
VASP: Introduction to Tutorials
0945 - 1000
CASTEP: Introduction to Tutorials
1000 - 1015
CRYSTAL: Introduction to Tutorials
1015 - 1045
Coffee Break
1045 - 1100
ONETEP: Introduction to Tutorials
1100 - 1115
CP2K: Introduction to Tutorials
1115 - 1130
ARCHER: Introduction to Practical Sessions
1130 - 1300
Practical Session
1300 - 1345
Lunch
1345 - 1545
Practical Session
1545 - 1615
Coffee Break
1615 - 1800
Practical Session
1805 - 1845
Coach Transfer to Hotel

Agenda Day 3 - 21/01/2016

0830 - 0915
Coach Transfer from Hotel
0915 - 0935
ONETEP: Advanced Functionalities and Roadmap
0935 - 0955
Quantum Espresso: Advanced Functionalities and Roadmap
0955 - 1015
CRYSTAL: Advanced Functionalities and Roadmap
1015 - 1035
Coffee Break
1035 - 1055
VASP: Advanced Functionalities and Roadmap
1055 - 1115
CP2K: Advanced Functionalities and Roadmap
1115 - 1135
CASTEP: Advanced Functionalities and Roadmap
1135 - 1300
Practical Session
1300 - 1345
Lunch
1345 - 1600
Practical Session
1600 - 1620
Coffee Break
1620 - 1745
Practical Session
1750 - 1830
Coach Transfer to Hotel
1830 - 1915
Free Time
1915 - 1930
Walk to Conference Dinner
1930 - 2130
Conference Dinner

Agenda Day 4 - 22/01/2016

0830 - 0915
Coach Transfer from Hotel
0915 - 1000
Practical Session
1000 - 1045
Scientific Lecture 1 - RICHARD CATLOW (UCL) 'Predictive Modelling in Catalytic Science'
1045 - 1100
Coffee Break
1100 - 1145
Scientific Lecture 2 - STEWART CLARK (Durham) 'Non-local density functional theory'
1145 - 1245
Individual Surgery Sessions
1245 - 1300
Concluding Remarks
1300 - 0600
Workshop Closes

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