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Timetable

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Programming & Basic Simulations

July 19 Day 0
Time Activity Location
12:00ish - 18:30 Arrival 📍 Park View Accomodation Reception
July 20 Day 1
Time Activity Location
8:00 - 8.55 Coffee breakfast 📍 BH
8:55 - 9.05 Quick Intro - Ioan Bogdan Magdau 📍 HB Lecture Theatre1
9:05 - 10:00 Fortran I/Python I AE/LL 📍 HB Lecture Theatre1/HB 1.Full PC Cluster
10:00 - 11:00 Fortran II/Python II AE/LL 📍 HB Lecture Theatre1/HB 1.Full PC Cluster
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Fortran III/Python III AE/LL 📍 HB Lecture Theatre1/HB 1.Full PC Cluster
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Fortran Practical/Python 📍 HB 1.Full PC Cluster/ HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Practical 📍 HB 1.Full PC Cluster/ HB 1.Full PC Cluster
18:00-20:00 Dinner 📍 BH Foyer
July 21 Day 2
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH foyer
9:00 - 10:00 Fortran IV/Python IV AE/LL 📍 HB Lecture Theatre3/HB 1.Full PC Cluster
10:00 - 11:00 Fortran V/Python V AE/LL 📍 HB Lecture Theatre3/HB 1.Full PC Cluster
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Fortran VI/Python VI AE/LL 📍 HB Lecture Theatre3/HB 1.Full PC Cluster
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Fortran Practical/Python 📍 HB 1.Full PC Cluster/ HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Fortran Practical/Python 📍 HB 1.Full PC Cluster/ HB 1.Full PC Cluster
17:30 - 20:00 Poster Session 📍 Hadrian Building Lindisfarne room
July 22 Day 3
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH foyer
9:00 - 10:00 Overview of molecular simulations - PC 📍 HB Lecture Theatre3
10:00 - 11:00 Statistical Mechanics 1 - LL 📍 HB Lecture Theatre3
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Statistical Mechanics 2 - LL 📍 HB Lecture Theatre3
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Practical - Stat Mech Problems 📍 HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Practical - setup the cloud 📍 HB 1.Full PC Cluster
17:10 - 18:10 Research Seminar: Prof Gabriele Sosso - University of Warwick 📍 HB Lecture Theatre1
18:10 - 20:15 Dinner 📍 BH Foyer
July 23 Day 4
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
9:00 - 10:00 Introduction to force fields - PC 📍 HB Lecture Theatre3
10:00 - 11:00 Monte Carlo 1 - NA 📍 HB Lecture Theatre3
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Monte Carlo 2 - NA 📍 HB Lecture Theatre3
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Practical - MC integration 📍 HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Practicals - Intro to MC 📍 HB 1.Full PC Cluster
17:10 - 18:10 Research Seminar: Dr Cristina Trujillo - University of Manchester 📍 —
18:10-20:00 Dinner 📍 BH Foyer
July 24 Day 5
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
9:00 - 10:00 Molecular Dynamics 1 - CF 📍 HB Lecture Theatre3
10:00 - 11:00 Molecular Dynamics 2 - CF 📍 HB Lecture Theatre3
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Monte Carlo 3 - MA 📍 HB Lecture Theatre3
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Practical - Intro to MD 📍 HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Practicals - Phase Equilibria 📍 HB 1.Full PC Cluster
17:10 - 18:10 Research Seminar:Dr Raffaela Cabriolu - Norwegian University Of Science and Technology 📍 HB Lecture Theatre2
18:10-20:15 Dinner 📍 BH Foyer
July 25 Day 6
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
9:00 - 10:00 Molecular Dynamics 3 - MA 📍 HB Lecture Theatre1
10:00 - 11:00 Long-range forces - JH 📍 HB Lecture Theatre1
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Optimisation methods and dealing with rare events - JH 📍 HB Lecture Theatre1
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Practicals - Stability + accur MD 📍 HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Practicals - MD Constraints 📍 HB 1.Full PC Cluster
17:10 - 18:15 Student Seminars 📍 HB Lecture Theatre1
18:15-20:15 Dinner 📍 BH Foyer
July 26 Free day Day 7
Time Activity Location
8:00 - 10:00ish Coffee breakfast 📍 BH Foyer
July 27 Day 8
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
9:00 - 10:00 Free energy methods 1 - GT 📍 HB Lecture Theatre3
10:00 - 11:00 Free energy methods 2 - GT 📍 HB Lecture Theatre3
11:00 - 11:30 Coffee break 📍 HB Foyer
11:30 - 12:30 Advanced Free Energy - GT 📍 HB Lecture Theatre3
12:30 - 14:00 Lunch 📍 BH Foyer
14:00 - 15:30 Practical Forcefield Optimisation 📍 HB 1.Full PC Cluster
15:30 - 16:00 Coffee break 📍 HB Foyer
16:00 - 17:00 Practical Thermostats 📍 HB 1.Full PC Cluster
17:10 - 18:10 Research Seminar: Dr Andrew McCluskey - University of Bristol 📍 HB Lecture Theatre2
19:00 - 22:00 Conference dinner 📍 CC

Advanced Lectures

Advanced lectures may be structured different depending on the lecturers' approach.

July 28 Day 9
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
11:00 - 11:30 Coffee break 📍 BH Foyer
12:30 - 14:00 Lunch 📍 BH Foyer
15:30 - 16:00 Coffee break 📍 BH Foyer.
17:10 - 18:10 Research Seminar: Dr Karl Travis - University of Sheffield 📍 BB G04
18:10-20:00 Dinner 📍 BH Foyer
July 29 Day 10
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
11:00 - 11:30 Coffee break 📍 BH Foyer
12:30 - 14:00 Lunch 📍 BH Foyer
15:30 - 16:00 Coffee break 📍 BH Foyer
18:10-20:00 Dinner 📍 BH Foyer
July 30 Day 11
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
11:00 - 11:30 Coffee break 📍 BH Foyer
12:30 - 14:00 Lunch 📍 BH Foyer

Machine Learning Interatomic Potentials

July 28 Day 9
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
9:00 - 10:00 Brief introduction to Machine learnt Interatomic potentials - IBM 📍 BH Foyer
10:00 - 11:00 — 📍 —
11:00 - 11:30 Coffee break 📍 BH Foyer
11:30 - 12:30 — 📍 BH Foyer
12:30 - 14:00 Lunch 📍 BH Foyer
15:30 - 16:00 Coffee break 📍 BH Foyer.
17:10 - 18:10 Research Seminar: Dr Karl Travis - University of Sheffield 📍 BB G04
18:10-20:00 Dinner 📍 BH Foyer
July 29 Day 10
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
11:00 - 11:30 Coffee break 📍 BH Foyer
12:30 - 14:00 Lunch 📍 BH Foyer
15:30 - 16:00 Coffee break 📍 BH Foyer
18:10-20:00 Dinner 📍 BH Foyer
July 30 Day 11
Time Activity Location
8:00 - 9:00ish Coffee breakfast 📍 BH Foyer
11:00 - 11:30 Coffee break 📍 BH Foyer
12:30 - 14:00 Lunch 📍 BH Foyer