[Avogadro-Discuss] Questions about dipole moments

2012-12-09 Thread Steven Petrovic
Dear List Members, I am building some simple molecules in Avogadro for a future lab experiment. I built carbon dioxide by selecting carbon and a double bond order, and I turned off the adjust hydrogens box. I created C = C = C, went back and selected oxygen, and clicked on the outer carbon atoms to

Re: [Avogadro-Discuss] Questions about dipole moments

2012-12-10 Thread Steven Petrovic
niversity of Pittsburgh > tel: (412) 648-0492 > email: geo...@pitt.edu > web: http://hutchison.chem.pitt.edu/ > > On Dec 10, 2012, at 2:12 AM, Steven Petrovic wrote: > > Dear List Members, > I am building some simple molecules in Avogadro for a future lab > experiment. I b

[Avogadro-Discuss] Inability to calculate carbon dioxide dipole moment?

2013-01-19 Thread Steven Petrovic
, Ubuntu has not put the latest version of Avogadro in its repository. I cannot explain why such discrepancies exist in the software and so I'm calling on the users and developers of Avogadro for some help on explaining or overcoming such discrepancies. Thank you for your assistance, Steve -- Dr. S

[Avogadro-Discuss] Stability of Avogadro 2

2013-12-03 Thread Steven Petrovic
!) or with Avogadro 1 & 2 unable to co-exist on the same PC of this vintage (purchased in 2007)? Thanks, Steve -- Dr. Steven Petrovic Professor of Chemistry Southern Oregon University 1250 Siskiyou Blvd. Ashland, OR 97520 (541) 552-

Re: [Avogadro-Discuss] Stability of Avogadro 2

2013-12-03 Thread Steven Petrovic
. Hanwell < marcus.hanw...@kitware.com> wrote: > On Tue, Dec 3, 2013 at 8:45 PM, Steven Petrovic wrote: > > Hi All, > > I am running Windows Vista on a Toshiba laptop (2 GB RAM, 1.46 GHz > processor > > speed). Although I have no trouble running Avogadro 1 on my ma

[Avogadro-Discuss] Dipole moment issues with Avogadro 1.2.0 beta

2016-06-07 Thread Steven Petrovic
direction of the dipole points in the opposite direction (arrow points in the direction of the partial positive charge, which is opposite of accepted convention). I was testing the Windows executable file. Thanks, Steve -- Dr. Steven Petrovic Professor of Chemistry Southern Oregon University 1250