Add fermionic operators demo by soranjh · Pull Request #813 · PennyLaneAI/demos

soranjh · 2023-06-01T21:12:29Z

Title:
Fermionic Operators

Summary:
This demo shows how to use PennyLane's in-built functionalities to build fermionic operators, use them to construct Hamiltonians, and map them to the qubit basis.

Relevant references:

Possible Drawbacks:

Related GitHub Issues:

demonstrations/fermionic_operators/creation.jpg

demonstrations/tutorial_fermionic_operators.py

Co-authored-by: ixfoduap <40441298+ixfoduap@users.noreply.github.com>

demonstrations/tutorial_fermionic_operators.py

Co-authored-by: Tom Bromley <49409390+trbromley@users.noreply.github.com>

isaacdevlugt

LGTM!

CatalinaAlbornoz

I've added a couple of comments.

The demo looks very good Soran!

demonstrations/tutorial_fermionic_operators.py

ixfoduap

Just left a few suggestions, please address before merging

demonstrations/tutorial_fermionic_operators.py

Co-authored-by: ixfoduap <40441298+ixfoduap@users.noreply.github.com>

CatalinaAlbornoz

It's probably safe to set the publishing date to Tuesday. If something happens we can change the date later.

Great explanation about extending the integrals!

demonstrations/tutorial_fermionic_operators.metadata.json

demonstrations/tutorial_fermionic_operators.py

Added the large and small fermionic operators demo thumbnails

…nto fermionic_demo

CatalinaAlbornoz

Added the two thumbnails in the metadata

demonstrations/tutorial_fermionic_operators.metadata.json

Co-authored-by: Catalina Albornoz <albornoz.catalina@hotmail.com>

* Development branch * Bumped requirement package versions (#667) * Bumped jax versions * Updated neural-tangents * Merge dev in master following v0.28.0 release of PennyLane (#671) (#672) * Development branch * Bumped requirement package versions (#667) * Bumped jax versions * Updated neural-tangents * Apply suggestions from code review Co-authored-by: Josh Izaac <josh146@gmail.com> Co-authored-by: GitHub Nightly Merge Action <actions@github.com> Co-authored-by: Rashid N H M <95639609+rashidnhm@users.noreply.github.com> Co-authored-by: Jay Soni <jbsoni@uwaterloo.ca> Co-authored-by: Josh Izaac <josh146@gmail.com> Co-authored-by: GitHub Nightly Merge Action <actions@github.com> * Update chemical reactions demo to use pyscf for openshell H3 (#704) * use pyscf for openshell H3 * change date and fix interface warning * Change ibm device in Quantum volume (#703) * Ibm oslo * Update to new hardware * Change to Lima * Typo * Replace * One below * Update demos to remove warnings (#705) * Added interface, removed deprecated functionality * Addressing PR comments --------- Co-authored-by: Romain Moyard <rmoyard@gmail.com> * Update classical shadows (#708) * More * typo * Trigger CI * lightning req no depth * Trigger CI * Update SPSA demo to count circuit executions manually. (#706) * new version of SPSA demo * Update demonstrations/spsa.py Co-authored-by: Josh Izaac <josh146@gmail.com> * simplify code, update outputs and figures * Apply suggestions from code review Co-authored-by: Romain Moyard <rmoyard@gmail.com> * review and tweaking * make spsa an executing tutorial * move file * fix links * fix some more links * author bio * line breaks, undo link change, fixing them actually * links... * links again... bio * update to count executions manually * reword device executions -> circuit executions. avoid recreating device and qnode * print executions --------- Co-authored-by: Josh Izaac <josh146@gmail.com> Co-authored-by: Romain Moyard <rmoyard@gmail.com> * Updated adaptive circuits demo for new return type (#735) * Update automatically run demos to be able to execute with v0.30 (#741) * fix toric code and classical kernels demos (#740) * FIx photonics and noisy demos (#742) * FIx two demos * small change * wrap relevant results in np.array (#743) * Updated demos to work with return types (#744) * Update demos for new return types (#754) * remove pennylane-sf from dependencies * try to use developement lightning * force upgrade of lightnign * make tutorial_gbs non-executable --------- Co-authored-by: Romain Moyard <rmoyard@gmail.com> Co-authored-by: Matthew Silverman <matthews@xanadu.ai> Co-authored-by: Mudit Pandey <mudit.pandey@xanadu.ai> Co-authored-by: lillian542 <38584660+lillian542@users.noreply.github.com> * remove nlopt from list of requirements (#755) * use dev version of lightning for demo checker (#759) * Improve formatting of output in toric code demo (#762) * round outputs on toric code * Update demonstrations/tutorial_toric_code.py Co-authored-by: Mudit Pandey <mudit.pandey@xanadu.ai> --------- Co-authored-by: Matthew Silverman <matthews@xanadu.ai> Co-authored-by: Mudit Pandey <mudit.pandey@xanadu.ai> * use lightning in quantumvolume; fix qnspsa for new return; use H.sparse_matrix (#757) * use lightning in quantumvolume; fix qnspsa for new return * stop using sparse_hamiltonian * Update manually run demos (#766) * Added changes to manual demos * Updated output as found in rerun * Trigger CI * Add warnings to pennylane-sf plugins and expected output (#761) * add warnings to pennylane-sf plugins, add output * Apply suggestions from code review Co-authored-by: Tom Bromley <49409390+trbromley@users.noreply.github.com> Co-authored-by: Josh Izaac <josh146@gmail.com> * add warning to quantum neural net --------- Co-authored-by: Tom Bromley <49409390+trbromley@users.noreply.github.com> Co-authored-by: Josh Izaac <josh146@gmail.com> * dev (#824) * Update requirements.txt (#825) * Update resource estimation demo for non-cubic systems (#823) * Change private methods in adjoint diff tutorial (#832) * adjoint diff tutorial improvement * Apply suggestions from code review Co-authored-by: Mudit Pandey <mudit.pandey@xanadu.ai> Co-authored-by: Matthew Silverman <matthews@xanadu.ai> * update date --------- Co-authored-by: Mudit Pandey <mudit.pandey@xanadu.ai> Co-authored-by: Matthew Silverman <matthews@xanadu.ai> * Add fermionic operators demo (#813) * Fixes for 0.31 release (#835) * Updated ensemble demo * Trigger ci * Update circuit cutting demo * Updated stop_recording * Update tutorial to not rely on tape context * Update demonstrations/tutorial_quantum_circuit_cutting.py Co-authored-by: Matthew Silverman <matthews@xanadu.ai> --------- Co-authored-by: Matthew Silverman <matthews@xanadu.ai> * Modify image in fermionic demo (#838) * use new image * Added hero_illustrationd folder to _static, added fermionic_ops_hero.png, modified tutorial_fermionic_operators.py and metadata to add hero image and delete previous image. --------- Co-authored-by: CatalinaAlbornoz <albornoz.catalina@hotmail.com> * use pinned versions of pennylane and plugins (#840) --------- Co-authored-by: GitHub Nightly Merge Action <actions@github.com> Co-authored-by: Rashid N H M <95639609+rashidnhm@users.noreply.github.com> Co-authored-by: Jay Soni <jbsoni@uwaterloo.ca> Co-authored-by: soranjh <40344468+soranjh@users.noreply.github.com> Co-authored-by: Romain Moyard <rmoyard@gmail.com> Co-authored-by: Mudit Pandey <mudit.pandey@xanadu.ai> Co-authored-by: David Wierichs <davidwierichs@gmail.com> Co-authored-by: trbromley <brotho02@gmail.com> Co-authored-by: Christina Lee <chrissie.c.l@gmail.com> Co-authored-by: Matthew Silverman <matthews@xanadu.ai> Co-authored-by: lillian542 <38584660+lillian542@users.noreply.github.com> Co-authored-by: Tom Bromley <49409390+trbromley@users.noreply.github.com> Co-authored-by: Guillermo Alonso-Linaje <65235481+KetpuntoG@users.noreply.github.com> Co-authored-by: CatalinaAlbornoz <albornoz.catalina@hotmail.com>

add fermionic operators demo

bcab2e9

soranjh added the WIP label Jun 1, 2023

soranjh commented Jun 1, 2023

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soranjh and others added 10 commits June 1, 2023 19:25

add the first examples

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add mapping section

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add mapping section

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add toy example

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correct code

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add hydrogen example

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add diag code

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modify text

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Merge branch 'dev' into fermionic_demo

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soranjh marked this pull request as ready for review June 6, 2023 17:21

soranjh removed the WIP label Jun 6, 2023

soranjh commented Jun 6, 2023

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soranjh commented Jun 6, 2023

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soranjh added 3 commits June 6, 2023 13:29

rename operators

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rename operators

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correct ref

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ixfoduap requested changes Jun 7, 2023

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soranjh and others added 2 commits June 8, 2023 09:29

apply suggestions from code review

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Co-authored-by: ixfoduap <40441298+ixfoduap@users.noreply.github.com>

add review comments

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soranjh requested review from ixfoduap and trbromley June 8, 2023 18:44

soranjh changed the title ~~[wip] add fermionic operators demo~~ Add fermionic operators demo Jun 8, 2023

trbromley reviewed Jun 8, 2023

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Apply suggestions from code review

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Co-authored-by: Tom Bromley <49409390+trbromley@users.noreply.github.com>

soranjh requested a review from trbromley June 8, 2023 20:13

Merge branch 'dev' into fermionic_demo

350d712

soranjh requested review from CatalinaAlbornoz and isaacdevlugt June 17, 2023 15:37

isaacdevlugt approved these changes Jun 19, 2023

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CatalinaAlbornoz reviewed Jun 20, 2023

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soranjh added 2 commits June 20, 2023 14:21

Merge branch 'dev' into fermionic_demo

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add review comments

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soranjh requested a review from CatalinaAlbornoz June 20, 2023 19:17

soranjh and others added 2 commits June 20, 2023 18:12

add new image and text

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Merge branch 'dev' into fermionic_demo

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ixfoduap approved these changes Jun 21, 2023

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soranjh and others added 4 commits June 21, 2023 14:29

Apply suggestions from code review

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Co-authored-by: ixfoduap <40441298+ixfoduap@users.noreply.github.com>

add review comments

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add review comments

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Merge branch 'dev' into fermionic_demo

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CatalinaAlbornoz approved these changes Jun 21, 2023

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CatalinaAlbornoz and others added 3 commits June 21, 2023 16:56

added fermionic operators demo thumbnails

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Added the large and small fermionic operators demo thumbnails

apply review comments

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Merge branch 'fermionic_demo' of https://github.com/PennyLaneAI/qml i…

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…nto fermionic_demo

CatalinaAlbornoz reviewed Jun 21, 2023

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soranjh and others added 8 commits June 21, 2023 17:03

Apply suggestions from code review

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Co-authored-by: Catalina Albornoz <albornoz.catalina@hotmail.com>

change var name

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update image name

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correct broken links

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add print

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modify equation

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change variable names

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correct math

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soranjh merged commit 21061d0 into dev Jun 23, 2023

soranjh deleted the fermionic_demo branch June 23, 2023 17:24

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soranjh commented Jun 1, 2023

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