 Parent Directory
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Ag.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Ag.u3.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Ag.u6.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Al.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Amber.99.frc
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1363
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2 years |
gezelter |
Adding alternate water models to Amber parameters. The approved model
for Amber… |
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Amber.frc
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1563
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8 months |
gezelter |
Matched default Charges for OH and HO (Hydroxyl) to the values from
OPLS paper.
… |
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Au.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Au.u3.funcfl
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1024
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5 years |
tim |
Massive changes preparing for release of OOPSE-4: The main difference
is that th… |
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Au.u6.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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CLAYFF.frc
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1314
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3 years |
gezelter |
fixed a few bugs in the options, added base atom types
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Cu.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Cu.u3.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Cu.u6.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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DUFF2.frc
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1556
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8 months |
chuckv |
Changed DUFF to match new option section format.
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EADM.frc
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1607
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5 months |
jmichalk |
Added the EADM.frc forcefield file -JRM |
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EAM.VC.frc
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1449
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19 months |
gezelter |
Aluminum fixes
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EAM.frc
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1449
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19 months |
gezelter |
Aluminum fixes
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EAM.u3.frc
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1279
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3 years |
gezelter |
All Your Base are belong to us!
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EAM.u6.frc
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1279
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3 years |
gezelter |
All Your Base are belong to us!
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Makefile
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1604
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5 months |
jmichalk |
This commit should allow EADM simulations to be run on the cluster. Main additio… |
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MnM.frc
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1623
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4 months |
gezelter |
Adding Repulsive Power potential
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Ni.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Ni.u3.funcfl
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1024
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5 years |
tim |
Massive changes preparing for release of OOPSE-4: The main difference
is that th… |
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Ni.u6.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Pd.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Pd.u3.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Pd.u6.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Pt.VC.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Pt.u3.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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Pt.u6.funcfl
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2
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7 years |
gezelter |
Import of OOPSE v. 2.0
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SuttonChen.QSC.frc
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1279
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3 years |
gezelter |
All Your Base are belong to us!
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SuttonChen.SC.frc
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1279
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3 years |
gezelter |
All Your Base are belong to us!
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SuttonChen.frc
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1279
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3 years |
gezelter |
All Your Base are belong to us!
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WATER.frc
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1390
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2 years |
gezelter |
Almost all of the changes necessary to create OpenMD out of our old
project (OOP… |
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element.txt
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760
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6 years |
tim |
adding openbabel data files
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