yluo - compmatphys

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Viewing 15 topics - 1 through 15 (of 18 total)

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- HF or DFT
  Started by: yluo in: Hartree-Fock versus DFT
- 1
- 1
- 2 months, 3 weeks ago
  yluo
- Correlation
  Started by: yluo in: correlation
- 1
- 1
- 2 months, 3 weeks ago
  yluo
- Jacob’s Ladder
  Started by: yluo in: XC-functional
- 1
- 1
- 2 months, 3 weeks ago
  yluo
- DFT for solar system
  Started by: yluo in: Kohn-Sham equations
- 1
- 1
- 2 months, 3 weeks ago
  yluo
- 2nd HK theorem
  Started by: yluo in: second Hohenberg-Kohn theorem
- 1
- 1
- 2 months, 3 weeks ago
  yluo
- what’s the problem?
  Started by: yluo in: so what’s the problem?
- 2
- 2
- 3 months ago
  Ksubh08
- Differences
  Started by: yluo in: first Hohenberg-Kohn theorem
- 1
- 1
- 3 months, 1 week ago
  yluo
- Failure of BO approximation
  Started by: yluo in: the Born-Oppenheimer approximation
- 1
- 1
- 3 months, 3 weeks ago
  yluo
- Q1
  Started by: yluo in: the Schrödinger equation – 1
- 1
- 1
- 4 months ago
  yluo
- functionals
  Started by: yluo in: functions and functionals
- 1
- 1
- 4 months ago
  yluo
- computer specs
  Started by: yluo in: hardware 1
- 1
- 1
- 4 months ago
  yluo
- theory or simulation
  Started by: yluo in: theory versus computation
- 1
- 1
- 4 months ago
  yluo
- differences
  Started by: yluo in: advantages question 3
- 1
- 1
- 4 months ago
  yluo
- materials
  Started by: yluo in: advantages question 2
- 1
- 1
- 4 months ago
  yluo
- how many bridges?
  Started by: yluo in: Advantages question 1
- 1
- 1
- 4 months ago
  yluo

Viewing 15 topics - 1 through 15 (of 18 total)