Re: [Jmol-users] Gamess atomic charge?

2004-08-28 Thread Rajarshi Guha
On Fri, 2004-08-27 at 23:37, Miguel wrote: > Rajarshi wrote: > > Thanks. I've attached the input file for the gamess run (water.inp), the > > output file (water.dat) as well as stdout (piped to a file, water.out) > > Rajarshi, > > The names file you provided contains the following: > ATOM A

Re: [Jmol-users] Gamess atomic charge?

2004-08-28 Thread Egon Willighagen
-BEGIN PGP SIGNED MESSAGE- Hash: SHA1 On Saturday 28 August 2004 05:37, Miguel wrote: > Rajarshi wrote: > > Thanks. I've attached the input file for the gamess run (water.inp), the > > output file (water.dat) as well as stdout (piped to a file, water.out) > > Rajarshi, > > The names file y