Chemistry
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Tyberius's user avatar
Tyberius's user avatar
Tyberius
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Developer of the Jaguar electronic structure program at Schrodinger.

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All Questions Answers
Score Newest
answer
69
Is it true that heavy water is not blue?
Apr 4, 2017
answer
49
What volume does one mole of an ideal gas occupy?
Aug 2, 2017
question
25
Are stronger bonds always shorter?
Apr 27, 2017
answer
20
Why do we not generally have "enneane"?
Apr 28, 2018
answer
18
Why do Enantiomers have different chemical properties with optically active reagents?
Jun 3, 2021
question
16
Are the canonical orbitals of Hartree-Fock also the natural orbitals?
Jul 24, 2017
answer
15
Why don't the MO energies sum up to Hartree-Fock SCF value?
Jul 2, 2021
answer
15
Molecular orbital diagram for BF3
Aug 22, 2017
answer
14
Etymology of saturation degrees (-ane, -ene, -yne) in aliphatic compounds
Dec 2, 2017
answer
14
Predicting sigma bond overlap strengths of s-s, p-p, s-p, sp-sp etc
Aug 19, 2017
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MathJax in the Android App
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Community Promotion Ads — 2019
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2019 Potential Moderator Election Community Interest Check
9
What is the best site to ask computational questions?
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38
What is the closest thing we have to "the" universal density functional?
30
Why does orbital-free DFT scale linearly with system size?
27
What makes the Cauchy principal value the "correct" value for a integral?
27
How to determine, a priori, whether a compound has multireference character?
23
When do relativistic effects need to be explicitly included?

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