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1 | 1 | cff-version: 1.1.0 |
2 | | -message: "If you use this script, please cite it as below." |
3 | | -title: "ConeZen: Visualiser for Conical Intersection Branching Planes" |
4 | | -version: "1.0.0" |
5 | | -doi: "10.5281/zenodo.YOUR_DOI_HERE" |
6 | | -date-released: "2025-07-14" |
| 2 | +message: "If you use this software, please cite it as below." |
7 | 3 | authors: |
8 | | - - family-names: "Dihingia" |
9 | | - given-names: "Kalpajyoti" |
10 | | - orcid: "https://orcid.org/0009-0006-1147-609X" |
11 | | - affiliation: "Banaras Hindu University (BHU)" |
12 | | -license: "GPL-3.0" |
13 | | -repository-code: "https://github.com/Kalpa08/conezen" |
14 | | -url: "https://github.com/Kalpa08/conezen" |
15 | | -abstract: | |
16 | | - ConeZen is a Python script to visualise the topology of conical intersection |
17 | | - branching planes using input gradients and NAC vectors. It implements |
18 | | - key theoretical models derived from the literature, and helps generate |
19 | | - 3D plots and animations of the conical intersection surfaces. |
20 | | - This tool was developed as part of Kalpa Dihingia's doctoral research |
21 | | - under the guidance of Banaras Hindu University (BHU). |
22 | | -
|
23 | | -preferred-citation: |
24 | | - type: software |
25 | | - authors: |
26 | | - - family-names: "Dihingia" |
27 | | - given-names: "Kalpajyoti" |
28 | | - title: "ConeZen: Visualiser for Conical Intersection Branching Planes" |
29 | | - version: v0.1-beta |
30 | | - doi: "10.5281/zenodo.YOUR_DOI_HERE" |
31 | | - date-released: 2025-07-19 |
| 4 | +- family-names: Dihingia |
| 5 | + given-names: Kalpajyoti |
| 6 | +orcid: https://orcid.org/0009-0006-1147-609X |
| 7 | +title: |
| 8 | +version: v0.1-beta |
| 9 | +date-released: 2025-07-19 |
| 10 | + |
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