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user213305
  • Member for 7 years, 7 months
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16 votes
Accepted

Relationship between the symmetry number of a molecule as used in rotational spectroscopy and point group

15 votes
Accepted

How are there two C3 rotation axes in ammonia?

9 votes

Why is NH2 negatively charged?

8 votes

Number of stereoisomers and symmetry of pentane-2,3,4-triol

8 votes

Is the differential, dp, exact or not?

6 votes
Accepted

Linear Combination of Atomic Orbitals

6 votes
Accepted

What are the differences between the Hilbert space and real space representations in chemistry?

5 votes
Accepted

Reaction between NaOH and CO2

5 votes

Reference states for molecular orbital energies in DFT calculations

5 votes
Accepted

Phases of Atomic or Molecular Orbitals

5 votes

Computing the commutator of the Fock and density matrices in AO basis (Hartree-Fock theory)

4 votes

How do you calculate the correct charge on F after F2 dissociates?

4 votes
Accepted

Why does enantiopure sec-butyl alcohol retain its optical activity over aqueous base but forms a racemic mixture over dilute sulphuric acid?

3 votes
Accepted

Why only molecules with three or more atoms undergo unimolecular reaction?

3 votes
Accepted

Can absolute enthalpy values be used to determine reaction enthalpy?

3 votes
Accepted

Probability density "AT" the nucleus?

3 votes
Accepted

charge density as a measure of lattice enthalpy & polarizing power?

3 votes
Accepted

Which has higher priority between unsaturated ring and unsaturated chain in the nomenclature of organic compounds?

3 votes
Accepted

Variational (Rayleigh-Ritz) method and multielectron wavefunction

2 votes

Which element has a greater second electron affinity, sulfur or oxygen?

2 votes
Accepted

Truncated CI Wavefunction

2 votes

Thought experiment for evaluating total energy

2 votes

Bromine monochloride equilibrium

1 vote

Why only structures corresponding to valleys on PES are taken into account?

1 vote

Estimating stability and mean life of anomalous tautomers

1 vote

Heat of reaction for the decomposition of AgCl means?

1 vote

Does the volume of solution increase during a neutralisation reaction?

1 vote
Accepted

Potential Energy Curve from Hartree-Fock Calculations

0 votes

Systematic and preferred names of acetamide

0 votes

Spontaneous reaction between chlorine and a hypothetical atom