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nmayhall-vt
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FermiCG
MIT License
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implemented methods to include ansatze list option in cluster eigenbasis and a test for 4 body contraction
#201
nbraunsc
opened
2 weeks ago
0
QDPT and SPT-PT2
#200
arnab82
closed
2 months ago
1
charge_transfer table computation function added
#199
arnab82
closed
7 months ago
0
SPT initialization problem solved
#198
arnab82
closed
7 months ago
1
"spt single and double exctitation function fixed"
#197
arnab82
closed
7 months ago
0
spt for excited states working now
#196
arnab82
closed
7 months ago
1
12 orbitals active space for tetracene dimer added
#195
arnab82
closed
9 months ago
1
bst or spt single excitation configurations creating function added
#194
arnab82
closed
9 months ago
1
Clusterstate S2 labels
#193
nmayhall-vt
opened
1 year ago
0
Debug bst mem
#192
nmayhall-vt
closed
1 year ago
1
Parallel diag
#191
nmayhall-vt
closed
1 year ago
1
Bst pt2
#190
nmayhall-vt
closed
1 year ago
1
Bst pt2
#189
nmayhall-vt
closed
1 year ago
2
Bst pt2
#188
nmayhall-vt
closed
1 year ago
1
svd algorithm update regarding forming sigma block .
#187
arnab82
closed
1 year ago
0
fixed operator call, updated readme install instructions, added ct analysis
#186
nbraunsc
closed
1 year ago
0
commented out the KrylovKit solve before the BlockDavidson solve
#185
nbraunsc
closed
2 years ago
0
deepcopy SLOW
#184
nmayhall-vt
opened
2 years ago
0
orthogonalization failure in davidson
#183
nmayhall-vt
closed
2 years ago
2
single precision integrals
#182
nmayhall-vt
opened
2 years ago
0
Separate out PySCF
#181
nmayhall-vt
closed
1 year ago
0
convergence not tracked in davidson
#180
nmayhall-vt
closed
2 years ago
0
use tblis for tensor contractions
#179
nmayhall-vt
closed
1 year ago
0
CompatHelper: add new compat entry for OrderedCollections at version 1, (keep existing compat)
#178
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for LinearMaps at version 3, (keep existing compat)
#177
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for BenchmarkTools at version 1, (keep existing compat)
#176
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for NPZ at version 0.4, (keep existing compat)
#175
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Optim at version 1, (keep existing compat)
#174
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for PyPlot at version 2, (keep existing compat)
#173
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for PyCall at version 1, (keep existing compat)
#172
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for GraphRecipes at version 0.5, (keep existing compat)
#171
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for PrettyTables at version 1, (keep existing compat)
#170
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Plotly at version 0.4, (keep existing compat)
#169
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Clustering at version 0.14, (keep existing compat)
#168
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for StaticArrays at version 1, (keep existing compat)
#167
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for JLD2 at version 0.4, (keep existing compat)
#166
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for JSON at version 0.21, (keep existing compat)
#165
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for ThreadPools at version 2, (keep existing compat)
#164
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Parameters at version 0.12, (keep existing compat)
#163
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Conda at version 1, (keep existing compat)
#162
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for IterativeSolvers at version 0.9, (keep existing compat)
#161
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Preconditioners at version 0.3, (keep existing compat)
#160
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Arpack at version 0.5, (keep existing compat)
#159
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for PProf at version 2, (keep existing compat)
#158
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Combinatorics at version 1, (keep existing compat)
#157
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for ProfileView at version 0.6, (keep existing compat)
#156
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Plots at version 1, (keep existing compat)
#155
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for NDTensors at version 0.1, (keep existing compat)
#154
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for Compat at version 3, (keep existing compat)
#153
github-actions[bot]
closed
2 years ago
0
CompatHelper: add new compat entry for StatProfilerHTML at version 1, (keep existing compat)
#152
github-actions[bot]
closed
2 years ago
0
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