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Releases: conradhuebler/curcuma

Curcuma 0.0.127

27 Dec 22:37
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Curcuma 0.0.127 Pre-release
Pre-release 
update rattle and tbliteinterface

Signed-off-by: Conrad Huebler <[email protected]>
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Curcuma 0.0.126

02 Dec 16:24
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Curcuma 0.0.126 Pre-release
Pre-release 
more smaller changes

Signed-off-by: Conrad Huebler <[email protected]>
Assets 3
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Curcuma 0.0.125

01 Dec 23:18
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Curcuma 0.0.125 Pre-release
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Merge branch 'master' of github.com:conradhuebler/curcuma
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Curcuma 0.0.124

27 Nov 16:13
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Curcuma 0.0.124 Pre-release
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add solvation to gfn methods via tblite

Signed-off-by: Conrad Huebler <[email protected]>
Assets 3
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Curcuma 0.0.123

22 Nov 23:34
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Curcuma 0.0.123 Pre-release
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fix csvr temperature

Signed-off-by: Conrad Hübler <[email protected]>
Assets 3
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Curcuma 0.0.122

22 Nov 10:54
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0.0.122
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Curcuma 0.0.122 Pre-release
Pre-release 
make random seed changeable for md runs

Signed-off-by: Conrad Huebler <[email protected]>
Assets 3
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Curcuma 0.0.121

20 Nov 13:41
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0.0.121
1b353e6
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Curcuma 0.0.121 Pre-release
Pre-release 
new (#6)

* readme change and logo

Signed-off-by: hattiwie <[email protected]>

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Signed-off-by: hattiwie <[email protected]>
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Curcuma 0.0.119

20 Nov 13:21
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0.0.119
6ab3455
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Curcuma 0.0.119 Pre-release
Pre-release 
logo (#5)

* logo

Signed-off-by: hattiwie <[email protected]>

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Signed-off-by: hattiwie <[email protected]>
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Curcuma 0.0.117

09 Nov 15:36
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Curcuma 0.0.117 Pre-release
Pre-release 
add gyration radius for post processing

Signed-off-by: Conrad Huebler <[email protected]>
Assets 3
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Curcuma 0.0.116

06 Oct 09:28
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0.0.116
51487d3
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Curcuma 0.0.116 Pre-release
Pre-release 
update tblite/xtb and extract dipole from xtb

Signed-off-by: Conrad Huebler <[email protected]>
Assets 3
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