minplascalc 0.7.0__py3-none-any.whl
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- minplascalc/data/species/C++.json +5008 -0
- minplascalc/data/species/C+.json +8836 -0
- minplascalc/data/species/C.json +9792 -0
- minplascalc/data/species/CO+.json +24 -0
- minplascalc/data/species/CO.json +29 -0
- minplascalc/data/species/O++.json +5530 -0
- minplascalc/data/species/O+.json +5405 -0
- minplascalc/data/species/O-.json +24 -0
- minplascalc/data/species/O.json +2925 -0
- minplascalc/data/species/O2+.json +23 -0
- minplascalc/data/species/O2-.json +23 -0
- minplascalc/data/species/O2.json +28 -0
- minplascalc/data/species/Si++.json +5967 -0
- minplascalc/data/species/Si+.json +2725 -0
- minplascalc/data/species/Si.json +5151 -0
- minplascalc/data/species/SiO+.json +25 -0
- minplascalc/data/species/SiO.json +30 -0
- minplascalc-0.7.0.dist-info/METADATA +99 -0
- minplascalc-0.7.0.dist-info/RECORD +21 -0
- minplascalc-0.7.0.dist-info/WHEEL +4 -0
- minplascalc-0.7.0.dist-info/licenses/LICENSE +674 -0
|
@@ -0,0 +1,24 @@
|
|
|
1
|
+
{
|
|
2
|
+
"name": "CO+",
|
|
3
|
+
"stoichiometry": {
|
|
4
|
+
"C": 1,
|
|
5
|
+
"O": 1
|
|
6
|
+
},
|
|
7
|
+
"molarmass": 0.028009596420090935,
|
|
8
|
+
"chargenumber": 1,
|
|
9
|
+
"polarisability": 1.227e-30,
|
|
10
|
+
"multiplicity": 2,
|
|
11
|
+
"effectiveelectrons": null,
|
|
12
|
+
"electroncrosssection": null,
|
|
13
|
+
"emissionlines": [],
|
|
14
|
+
"dissociationenergy": Infinity,
|
|
15
|
+
"ionisationenergy": Infinity,
|
|
16
|
+
"sigma_s": 1,
|
|
17
|
+
"g0": 4,
|
|
18
|
+
"w_e": 4.398389875484898e-20,
|
|
19
|
+
"b_e": 3.9276020512188334e-23,
|
|
20
|
+
"sources": [
|
|
21
|
+
"NIST Chemistry WebBook, NIST Standard Reference Database Number 69. PJ Linstrom and WG Mallard (Editors), National Institute of Standards and Technology, Gaithersburg MD., http://webbook.nist.gov/chemistry/, doi:10.18434/T4D303",
|
|
22
|
+
"TE Horton (1970). The Computation of Partition Functions and Thermochemistry Data for Atomic, Ionic, Diatomic, and Polyatomic Species, Technical Report 32-7425, NASA Jet Propulsion Laboratory, California Institute of Technology, 1970"
|
|
23
|
+
]
|
|
24
|
+
}
|
|
@@ -0,0 +1,29 @@
|
|
|
1
|
+
{
|
|
2
|
+
"name": "CO",
|
|
3
|
+
"stoichiometry": {
|
|
4
|
+
"C": 1,
|
|
5
|
+
"O": 1
|
|
6
|
+
},
|
|
7
|
+
"molarmass": 0.028010145,
|
|
8
|
+
"chargenumber": 0,
|
|
9
|
+
"polarisability": 1.953e-30,
|
|
10
|
+
"multiplicity": 1,
|
|
11
|
+
"effectiveelectrons": 8.775510204081632,
|
|
12
|
+
"electroncrosssection": [
|
|
13
|
+
2.6463905876539567e-34,
|
|
14
|
+
4.108173839102651e-38,
|
|
15
|
+
1.966327114101665,
|
|
16
|
+
4.50755687711815e-20
|
|
17
|
+
],
|
|
18
|
+
"emissionlines": [],
|
|
19
|
+
"dissociationenergy": 1.7798487991502877e-18,
|
|
20
|
+
"ionisationenergy": 2.245291223722296e-18,
|
|
21
|
+
"sigma_s": 1,
|
|
22
|
+
"g0": 1,
|
|
23
|
+
"w_e": 4.3102186261230426e-20,
|
|
24
|
+
"b_e": 3.836386155417607e-23,
|
|
25
|
+
"sources": [
|
|
26
|
+
"NIST Chemistry WebBook, NIST Standard Reference Database Number 69. PJ Linstrom and WG Mallard (Editors), National Institute of Standards and Technology, Gaithersburg MD., http://webbook.nist.gov/chemistry/, doi:10.18434/T4D303",
|
|
27
|
+
"TE Horton (1970). The Computation of Partition Functions and Thermochemistry Data for Atomic, Ionic, Diatomic, and Polyatomic Species, Technical Report 32-7425, NASA Jet Propulsion Laboratory, California Institute of Technology, 1970"
|
|
28
|
+
]
|
|
29
|
+
}
|