Chemistry
Profile Activity
Meta user
Network profile
1,024
reputation
6
22

B. Kelly

I guess you would say I am a scientist/engineer based on my degrees but when it comes to coding I seem to enjoy doing things the hard way.

I coded originally in Matlab, then Fortran, now Julia and Python. Julia is better than the rest :)

I am pretty good at thermodynamics, statistical mechanics, and physical chemistry... Free energy calculations, particularly, alchemical, are my jam.

26
answers
3
questions
~19k
people reached
  • Member for 2 years
  • 126 profile views
  • Last seen Feb 15 at 1:06

Communities (9)

Top Meta Posts
1
0

Top network posts

Top tags (39)

Score 28
Posts 8
Posts % 28
Score 17
Posts 9
Score 12
Posts 5
Score 10
Posts 2
Score 9
Posts 2
Score 7
Posts 7
View all tags →

Top posts (29)

All Questions Answers
Votes Newest
13 Is the differential, dp, exact or not? Mar 8 '19
8 Define, (actually define) the “stability” and “energy” of a compound Mar 15 '19
6 Minimizing energy of a molecule Mar 13 '19
6 Are there Exchange integrals in Semiempirical methods? Mar 25 '20
5 Z-Matrix Generator for Gaussian Feb 11 '19
4 Why is heat capacity defined as a partial derivative? Mar 10 '19
4 How do water models fit into force field methods? Mar 1 '19
3 Spin Operator algebra Mar 13 '20
3 Dynamic equilibrium in unsaturated solutions Nov 25 '19
3 What proportion of a combustion engine's output energy comes from the air? Mar 12 '19
View all questions and answers →

Badges (28)

Gold

—

Silver

6

Rarest

Bronze

22

Rarest

View all badges →