@Secret I think that is not possible with a relaxed scan via modredundant. Your best options may be to define a z-matrix with the dummy atom and do a rigid scan and then re-optimise the minima/TS you find to construct the PES. Or you could just go ahead and guess the TS-structures and run irc calculations afterwards to get the PES. Or you can guess the minima and run QST calculations to get the PES. I'm not too sure if avogadro's conformation explorer works either.
@Secret I think this would make a good question for the main page. Someone might have a better idea, or maybe a different program has better capabilities... I'll encourage you to ask it.
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Litmus paper is reacted first alkaline solution to get acidic condition so, it's turn blue colour. Then after that reacted to basic condition so, it's turn to red colour
@MelanieShebel The idea of a more regular "appointment" for ChemSE is good.
Maybe not necessary to have a long convention, but if one would know, every Wednesday (for example) at so-and-so is a short coming together, this reads for me like a recurrent "spring cleaning".
Did I understand this as your intent correctly, @MelanieShebel?
or "6 hours later", provided some are in Asia and ANZAC, others Europe, and the Americas.
Yet with the spread ChemSE among the users already has (geographically speaking), it may be beneficial to take into consideration the different time zones, too.
To find a time that is sufficiently convenient for the users in their local time.
Or several times per day.
As a thought, open to discussion / adapting change, how does ACS does with their webinars likely accessible in other places than the lower 48, too?
Are these webinars re-performed for other regions, too, or are they set-up "once" for all interested around the globe?
I share your observation, the conferences are at least as much about presentation of new (chemical) findings as well as finding a potential sparring partners.
Especially the poster sessions.
Other avenues, well, if researchers travel across the country for a small lecture, and when PIs "exchange" their co-workers.
For a project I have to determine the drug concentration release profile of self-made methylphenidate HCl (MHCl) extended release tablets (hydrophilic matrix). We are thus doing a dissolution test as described conform the US/Eur. Pharmacopeia. However a problem we are facing is that we are not su...
Litmus paper is reacted first alkaline solution to get acidic condition so, it's turn blue colour. Then after that reacted to basic condition so, it's turn to red colour
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