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11
votes
Calculating/Visualizing electronic density from orbital information written in the Molden format
density-functional-theory
software
computational-chemistry
software-recommendations
from-chem-se
asked Dec 27, 2020 at 17:44
mattermodeling.stackexchange.com
7
votes
The number of long-range interaction pairs in Tinker
software
computational-chemistry
molecular-mechanics
tinker
asked Jan 29, 2021 at 20:43
mattermodeling.stackexchange.com
7
votes
How to calculate 2D elastic constants of boron nitride monolayers from uniaxial strains?
vasp
elasticity
stress-strain
asked Apr 30 at 2:44
mattermodeling.stackexchange.com
Top Answers
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