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paduagroup
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clandpol
Polarisable force field for ionic liquids
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Missing fragment charge and dipole moment for c2c1im/an
#17
bbye98
opened
2 years ago
1
Added some fragments
#16
agiliopadua
closed
3 years ago
2
Counting H in water
#15
kateryna-goloviznina
closed
3 years ago
2
Simplified polarizer
#14
agiliopadua
closed
3 years ago
8
Updated README
#13
agiliopadua
closed
3 years ago
0
Input file problem
#12
kateryna-goloviznina
closed
3 years ago
3
Check atomic polarisability of H atoms
#11
kateryna-goloviznina
closed
3 years ago
2
LAMMPS input commands are written to file
#10
agiliopadua
closed
3 years ago
0
Pair-Drude file
#9
kateryna-goloviznina
closed
3 years ago
3
Important update of scaleLJ
#8
kateryna-goloviznina
closed
3 years ago
1
Avoid accented chars, keep compatible encoding
#7
agiliopadua
closed
3 years ago
3
Added tgnpt to examples and doc, plus some cosmetics
#6
agiliopadua
closed
3 years ago
1
Counting fluorine atoms attached to carbon
#5
kateryna-goloviznina
closed
3 years ago
1
PIL and DES
#4
kateryna-goloviznina
closed
3 years ago
0
Problem working through example in Readme
#3
william-pfalzgraff
closed
4 years ago
2
Generate pair-p.lmp
#2
olihammond
closed
4 years ago
1
Updated readme.md file
#1
olihammond
closed
4 years ago
1