Wolfram Language
Paclet Repository
Community-contributed installable additions to the Wolfram Language
Primary Navigation
Categories
Cloud & Deployment
Core Language & Structure
Data Manipulation & Analysis
Engineering Data & Computation
External Interfaces & Connections
Financial Data & Computation
Geographic Data & Computation
Geometry
Graphs & Networks
Higher Mathematical Computation
Images
Knowledge Representation & Natural Language
Machine Learning
Notebook Documents & Presentation
Scientific and Medical Data & Computation
Social, Cultural & Linguistic Data
Strings & Text
Symbolic & Numeric Computation
System Operation & Setup
Time-Related Computation
User Interface Construction
Visualization & Graphics
Random Paclet
Alphabetical List
Using Paclets
Create a Paclet
Get Started
Download Definition Notebook
Learn More about
Wolfram Language
QuantumChemistry
Symbols
ComputeVibrationalModes
ElectronicStructurePlot3D
ElectronicStructureResult
ModelChemistry
OptimizeMoleculeGeometry
PotentialEnergyScan
SinglePointEnergy
WolframChemistry`QuantumChemistry`
E
l
e
c
t
r
o
n
i
c
S
t
r
u
c
t
u
r
e
R
e
s
u
l
t
E
l
e
c
t
r
o
n
i
c
S
t
r
u
c
t
u
r
e
R
e
s
u
l
t
[
.
.
.
]
i
s
r
e
t
u
r
n
e
d
b
y
e
l
e
c
t
r
o
n
i
c
s
t
r
u
c
t
u
r
e
f
u
n
c
t
i
o
n
s
,
c
o
n
t
a
i
n
i
n
g
t
h
e
p
r
i
m
a
r
y
r
e
s
u
l
t
a
n
d
v
a
r
i
o
u
s
m
e
t
a
d
a
t
a
.
Examples
(
0
)
"
"