Tour
About Us
Meta
Loading…
current community
Stack Exchange
chat
Meta Stack Exchange
your communities
Sign up
or
log in
to customize your list.
more stack exchange communities
company blog
Log in
Stack Exchange
All Sites
Top Users
Digests
anne_onymous
top
accounts
reputation
activity
subscriptions
Top Questions
15
votes
Total spin and/or multiplicity for transition metal ions?
density-functional-theory
electronic-structure
quantum-chemistry
transition-metals
spin-orbit-coupling
asked Jun 9, 2020 at 17:35
mattermodeling.stackexchange.com
13
votes
Rule-of-thumb for Morse potential cutoff in molecular dynamics?
molecular-modeling
molecular-dynamics
intermolecular-forces
molecular-interactions
molecular-mechanics
asked May 17, 2020 at 21:16
mattermodeling.stackexchange.com
12
votes
3D Poisson equation solver for arbitrary charge distribution?
molecular-dynamics
electrostatic
charge-transfer
potential-energy-surface
finite-element-analysis
asked Jun 23, 2020 at 0:40
mattermodeling.stackexchange.com
11
votes
Quantifying electronic overlap?
density-functional-theory
electronic-structure
electron-correlation
electronic-transport
atomic-physics
asked Oct 13, 2020 at 17:37
mattermodeling.stackexchange.com
11
votes
Selection of appropriate Langevin damping parameter for MD of solid metal
molecular-dynamics
lammps
physical-properties-of-materials
statistical-thermodynamics
thermodynamics
asked Jan 30, 2021 at 20:12
mattermodeling.stackexchange.com
Top Answers
10
Is there any definitive evidence that implicit solvation methods are more accurate than explicit solvation methods for free energy calculations?
mattermodeling.stackexchange.com
Stack Exchange works best with JavaScript enabled