siman

Manager for DFT calculations

Project description

Manager for first-principles calculations.
For manual see wiki tab at github

If you use this package please cite:
Aksyonov et. al, Understanding migration barriers for monovalent ion insertion in transition metal oxide and phosphate based cathode materials: A DFT study, Comp. Mat. Sci. 154, 449-458, 2018

Project details

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This version

1.1.3

Jun 17, 2022

1.1.2

Jun 17, 2022

1.1.1

Jun 17, 2022

1.1.0

Jun 10, 2022

1.0.7

Jan 18, 2022

1.0.6

May 9, 2021

1.0.5.1

Mar 11, 2021

1.0.5

Mar 11, 2021

1.0.4

Mar 2, 2021

1.0.3

Mar 2, 2021

1.0.2

Feb 15, 2021

1.0.1

Feb 2, 2021

1.0.0.2

Dec 7, 2020

1.0.0.1

Nov 23, 2020

1.0.0

Nov 9, 2020

0.9.9.9

Mar 13, 2020

0.9.9.8

Mar 13, 2020

0.9.9.7

Mar 2, 2020

0.9.9.6

Mar 2, 2020

0.9.9.5

Feb 4, 2020

0.9.9.4

Nov 28, 2019

0.9.9.3

Nov 19, 2019

0.9.9.2

Nov 19, 2019

0.9.9.1

Aug 22, 2019

0.9.9

Aug 22, 2019

0.9.8

Jun 27, 2019

0.9.6

Feb 19, 2019

0.9.5.5

Nov 28, 2018

0.9.5.3

Oct 29, 2018

0.9.5.2

Oct 29, 2018

0.9.5.post0

Oct 26, 2018

0.9.5

Oct 23, 2018

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