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How can quantum computing be utilized to enhance molecular simulation and design in quantum chemistry? Specifically, what quantum algorithms and techniques can be employed for efficient computation of chemical properties and molecular dynamics simulations?
asked
9 hours
ago
in
Quantum Chemistry
0
votes
1
answer
34
views
Calculate the standard enthalpy change (in kJ/mol) for the dissolution of 3.50 g of potassium hydroxide (KOH) in 250.0 mL of water at 25°C, given that the molar heat of solution of KOH is -57.61 kJ/mol.
asked
2 days
ago
in
Chemical thermodynamics
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1
answer
42
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How does adding a substituent to a molecule affect its excitation energy? Use quantum chemical calculations to compare the excitation energies of a set of closely related molecules, one with a substituent and one without, and determine the effect of the substituent on the molecules' excited states.
asked
5 days
ago
in
Computational Chemistry
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1
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79
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Identify the product(s) and name the type of nucleophilic substitution reaction that occurs when 1-bromobutane reacts with sodium hydroxide in ethanol solvent.
asked
Jan 21
in
Organic Chemistry
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1
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23
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What is sleep debt?
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Jan 14
in
Psychology
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1
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24
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What is the biopsychosocial model?
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Jan 13
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Psychology
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1
answer
15
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What is the term for the process in which two atomic nuclei fuse together to make a single nucleus?
asked
Jan 7
in
Science
0
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1
answer
26
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What is a defining feature of deformed sedimentary rocks?
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Jan 6
in
Science
0
votes
1
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13
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What do many scientists think are the oldest eukaryotes?
asked
Jan 6
in
Science
0
votes
1
answer
35
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What component of cells is present in plant and bacterial cells but not animal cells?
asked
Jan 6
in
Science
0
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1
answer
38
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The largest absorption of heat comes during the vaporization of what?
asked
Jan 2
in
Science
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25
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What is a homogeneous mixture also known as?
asked
Dec 28, 2024
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Science
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