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Update notebooks for Qiskit 0.12.0 #777

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Update notebooks for Qiskit 0.12.0 #777

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04104d6
Remove initial_layout from swap passes. Update list of passes
Matt-Stypulkoski Aug 20, 2019
7646dfe
Add Z2Symmetries import. Replace two_qubit_reduced_operator with two_…
Matt-Stypulkoski Aug 20, 2019
9b1f9c1
Remove deprecation warning output
Matt-Stypulkoski Aug 20, 2019
7d86daf
Merge branch 'master' into qiskit012_tutorial_update
jaygambetta Aug 20, 2019
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220 changes: 107 additions & 113 deletions qiskit/advanced/aqua/chemistry/programmatic_approach.ipynb
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Original file line number Diff line number Diff line change
Expand Up @@ -49,6 +49,7 @@
"\n",
"# lib from Qiskit Aqua\n",
"from qiskit.aqua import Operator, QuantumInstance\n",
"from qiskit.aqua.operators import Z2Symmetries\n",
"from qiskit.aqua.algorithms import VQE, ExactEigensolver\n",
"from qiskit.aqua.components.optimizers import COBYLA\n",
"\n",
Expand Down Expand Up @@ -99,7 +100,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
"HF energy: -8.854072040283643\n",
"HF energy: -8.854072040283647\n",
"# of electrons: 4\n",
"# of spin orbitals: 12\n"
]
Expand Down Expand Up @@ -131,106 +132,106 @@
"name": "stdout",
"output_type": "stream",
"text": [
"IIII\t(-0.20765933501970843+0j)\n",
"IIIZ\t(-0.0937633748462618+0j)\n",
"IIZX\t(-0.003177581454819807+0j)\n",
"IIIX\t(0.003177581454819807+0j)\n",
"IIXX\t(-0.0012513965999782634+0j)\n",
"IIYY\t(0.0012513965999782634+0j)\n",
"IIZZ\t(-0.21162509515110325+0j)\n",
"IIXZ\t(0.019200533863114204+0j)\n",
"IIXI\t(0.019200533863114204+0j)\n",
"IIZI\t(0.35810269945770123+0j)\n",
"IZII\t(0.09376337484626177+0j)\n",
"ZXII\t(0.0031775814548198056+0j)\n",
"IXII\t(0.0031775814548198056+0j)\n",
"XXII\t(-0.0012513965999782738+0j)\n",
"YYII\t(0.0012513965999782738+0j)\n",
"ZZII\t(-0.21162509515110328+0j)\n",
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"XIII\t(0.01920053386311419+0j)\n",
"ZIII\t(-0.3581026994577012+0j)\n",
"IZIZ\t(-0.12182774215822034+0j)\n",
"IZZX\t(0.012144897228053009+0j)\n",
"IZIX\t(-0.012144897228053009+0j)\n",
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"IXIZ\t(0.012144897228053009+0j)\n",
"ZXIZ\t(0.012144897228053009+0j)\n",
"IXZX\t(-0.003265995499652904+0j)\n",
"ZXZX\t(-0.003265995499652904+0j)\n",
"IXIX\t(0.003265995499652904+0j)\n",
"ZXIX\t(0.003265995499652904+0j)\n",
"IXXX\t(-0.008650156860603548+0j)\n",
"ZXXX\t(-0.008650156860603548+0j)\n",
"IXYY\t(0.008650156860603548+0j)\n",
"ZXYY\t(0.008650156860603548+0j)\n",
"YYIZ\t(0.0316987459873487+0j)\n",
"XXIZ\t(-0.0316987459873487+0j)\n",
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"XXZX\t(0.00865015686060355+0j)\n",
"YYIX\t(0.00865015686060355+0j)\n",
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"XXXX\t(0.030981613344632574+0j)\n",
"YYYY\t(0.030981613344632574+0j)\n",
"XXYY\t(-0.030981613344632574+0j)\n",
"ZZIZ\t(0.05590251078515368+0j)\n",
"ZZZX\t(0.0018710427514123198+0j)\n",
"ZZIX\t(-0.0018710427514123198+0j)\n",
"ZZXX\t(0.003104004116078267+0j)\n",
"ZZYY\t(-0.003104004116078267+0j)\n",
"XIIZ\t(0.012841723180750613+0j)\n",
"XZIZ\t(-0.012841723180750613+0j)\n",
"XIZX\t(-0.002352152173238769+0j)\n",
"XZZX\t(0.002352152173238769+0j)\n",
"XIIX\t(0.002352152173238769+0j)\n",
"XZIX\t(-0.002352152173238769+0j)\n",
"XIXX\t(-0.007975908750559497+0j)\n",
"XZXX\t(0.007975908750559497+0j)\n",
"XIYY\t(0.007975908750559497+0j)\n",
"XZYY\t(-0.007975908750559497+0j)\n",
"ZIIZ\t(0.11346110712685867+0j)\n",
"ZIZX\t(-0.010838363828730848+0j)\n",
"ZIIX\t(0.010838363828730848+0j)\n",
"ZIXX\t(-0.03355135311124219+0j)\n",
"ZIYY\t(0.03355135311124219+0j)\n",
"IZZZ\t(-0.05590251078515368+0j)\n",
"IZXZ\t(-0.012841723180750615+0j)\n",
"IZXI\t(-0.012841723180750615+0j)\n",
"IXZZ\t(-0.0018710427514123196+0j)\n",
"ZXZZ\t(-0.0018710427514123196+0j)\n",
"IXXZ\t(0.0023521521732387685+0j)\n",
"ZXXZ\t(0.0023521521732387685+0j)\n",
"IXXI\t(0.0023521521732387685+0j)\n",
"ZXXI\t(0.0023521521732387685+0j)\n",
"YYZZ\t(-0.0031040041160782664+0j)\n",
"XXZZ\t(0.0031040041160782664+0j)\n",
"YYXZ\t(0.007975908750559497+0j)\n",
"XXXZ\t(-0.007975908750559497+0j)\n",
"YYXI\t(0.007975908750559497+0j)\n",
"XXXI\t(-0.007975908750559497+0j)\n",
"ZZZZ\t(0.08447056807294816+0j)\n",
"ZZXZ\t(-0.008994911953942152+0j)\n",
"ZZXI\t(-0.008994911953942152+0j)\n",
"XIZZ\t(-0.008994911953942152+0j)\n",
"XZZZ\t(0.008994911953942152+0j)\n",
"XIXZ\t(0.006612047066148212+0j)\n",
"XZXZ\t(-0.006612047066148212+0j)\n",
"XIXI\t(0.006612047066148212+0j)\n",
"XZXI\t(-0.006612047066148212+0j)\n",
"ZIZZ\t(0.06035891281077614+0j)\n",
"ZIXZ\t(0.011019231644706083+0j)\n",
"ZIXI\t(0.011019231644706083+0j)\n",
"IZZI\t(0.11346110712685867+0j)\n",
"IXZI\t(-0.01083836382873085+0j)\n",
"ZXZI\t(-0.01083836382873085+0j)\n",
"YYZI\t(-0.03355135311124219+0j)\n",
"XXZI\t(0.03355135311124219+0j)\n",
"ZZZI\t(-0.06035891281077614+0j)\n",
"XIZI\t(-0.011019231644706081+0j)\n",
"XZZI\t(0.011019231644706081+0j)\n",
"ZIZI\t(-0.11344680300367628+0j)\n",
"IIII\t(-0.2076593350197074+0j)\n",
"IIIZ\t(-0.09376337484626278+0j)\n",
"IIZX\t(-0.0031775814548399956+0j)\n",
"IIIX\t(0.0031775814548399956+0j)\n",
"IIXX\t(-0.001251396599969751+0j)\n",
"IIYY\t(0.001251396599969751+0j)\n",
"IIZZ\t(-0.21162509515110128+0j)\n",
"IIXZ\t(0.019200533863109957+0j)\n",
"IIXI\t(0.019200533863109957+0j)\n",
"IIZI\t(0.3581026994577025+0j)\n",
"IZII\t(0.09376337484626282+0j)\n",
"ZXII\t(0.0031775814548399973+0j)\n",
"IXII\t(0.0031775814548399973+0j)\n",
"XXII\t(-0.0012513965999697415+0j)\n",
"YYII\t(0.0012513965999697415+0j)\n",
"ZZII\t(-0.21162509515110128+0j)\n",
"XZII\t(-0.019200533863109957+0j)\n",
"XIII\t(0.019200533863109957+0j)\n",
"ZIII\t(-0.3581026994577025+0j)\n",
"IZIZ\t(-0.12182774215821467+0j)\n",
"IZZX\t(0.012144897228064444+0j)\n",
"IZIX\t(-0.012144897228064444+0j)\n",
"IZXX\t(0.03169874598734439+0j)\n",
"IZYY\t(-0.03169874598734439+0j)\n",
"IXIZ\t(0.012144897228064444+0j)\n",
"ZXIZ\t(0.012144897228064444+0j)\n",
"IXZX\t(-0.0032659954996582014+0j)\n",
"ZXZX\t(-0.0032659954996582014+0j)\n",
"IXIX\t(0.0032659954996582014+0j)\n",
"ZXIX\t(0.0032659954996582014+0j)\n",
"IXXX\t(-0.008650156860609944+0j)\n",
"ZXXX\t(-0.008650156860609944+0j)\n",
"IXYY\t(0.008650156860609944+0j)\n",
"ZXYY\t(0.008650156860609944+0j)\n",
"YYIZ\t(0.03169874598734438+0j)\n",
"XXIZ\t(-0.03169874598734438+0j)\n",
"YYZX\t(-0.008650156860609944+0j)\n",
"XXZX\t(0.008650156860609944+0j)\n",
"YYIX\t(0.008650156860609944+0j)\n",
"XXIX\t(-0.008650156860609944+0j)\n",
"YYXX\t(-0.030981613344629504+0j)\n",
"XXXX\t(0.030981613344629504+0j)\n",
"YYYY\t(0.030981613344629504+0j)\n",
"XXYY\t(-0.030981613344629504+0j)\n",
"ZZIZ\t(0.055902510785159+0j)\n",
"ZZZX\t(0.0018710427514161882+0j)\n",
"ZZIX\t(-0.0018710427514161882+0j)\n",
"ZZXX\t(0.003104004116073226+0j)\n",
"ZZYY\t(-0.003104004116073226+0j)\n",
"XIIZ\t(0.012841723180756926+0j)\n",
"XZIZ\t(-0.012841723180756926+0j)\n",
"XIZX\t(-0.0023521521732445616+0j)\n",
"XZZX\t(0.0023521521732445616+0j)\n",
"XIIX\t(0.0023521521732445616+0j)\n",
"XZIX\t(-0.0023521521732445616+0j)\n",
"XIXX\t(-0.00797590875056439+0j)\n",
"XZXX\t(0.00797590875056439+0j)\n",
"XIYY\t(0.00797590875056439+0j)\n",
"XZYY\t(-0.00797590875056439+0j)\n",
"ZIIZ\t(0.1134611071268544+0j)\n",
"ZIZX\t(-0.010838363828740441+0j)\n",
"ZIIX\t(0.010838363828740441+0j)\n",
"ZIXX\t(-0.03355135311123841+0j)\n",
"ZIYY\t(0.03355135311123841+0j)\n",
"IZZZ\t(-0.055902510785159+0j)\n",
"IZXZ\t(-0.012841723180756926+0j)\n",
"IZXI\t(-0.012841723180756926+0j)\n",
"IXZZ\t(-0.001871042751416188+0j)\n",
"ZXZZ\t(-0.001871042751416188+0j)\n",
"IXXZ\t(0.002352152173244561+0j)\n",
"ZXXZ\t(0.002352152173244561+0j)\n",
"IXXI\t(0.002352152173244561+0j)\n",
"ZXXI\t(0.002352152173244561+0j)\n",
"YYZZ\t(-0.003104004116073226+0j)\n",
"XXZZ\t(0.003104004116073226+0j)\n",
"YYXZ\t(0.00797590875056439+0j)\n",
"XXXZ\t(-0.00797590875056439+0j)\n",
"YYXI\t(0.00797590875056439+0j)\n",
"XXXI\t(-0.00797590875056439+0j)\n",
"ZZZZ\t(0.08447056807294587+0j)\n",
"ZZXZ\t(-0.008994911953942185+0j)\n",
"ZZXI\t(-0.008994911953942185+0j)\n",
"XIZZ\t(-0.008994911953942183+0j)\n",
"XZZZ\t(0.008994911953942183+0j)\n",
"XIXZ\t(0.006612047066151987+0j)\n",
"XZXZ\t(-0.006612047066151987+0j)\n",
"XIXI\t(0.006612047066151987+0j)\n",
"XZXI\t(-0.006612047066151987+0j)\n",
"ZIZZ\t(0.060358912810781123+0j)\n",
"ZIXZ\t(0.011019231644712395+0j)\n",
"ZIXI\t(0.011019231644712395+0j)\n",
"IZZI\t(0.1134611071268544+0j)\n",
"IXZI\t(-0.01083836382874044+0j)\n",
"ZXZI\t(-0.01083836382874044+0j)\n",
"YYZI\t(-0.03355135311123841+0j)\n",
"XXZI\t(0.03355135311123841+0j)\n",
"ZZZI\t(-0.060358912810781123+0j)\n",
"XIZI\t(-0.011019231644712394+0j)\n",
"XZZI\t(0.011019231644712394+0j)\n",
"ZIZI\t(-0.11344680300367244+0j)\n",
"\n",
"Representation: paulis, qubits: 4, size: 100\n"
]
Expand Down Expand Up @@ -261,10 +262,10 @@
" num_spin_orbitals -= len(remove_list)\n",
"\n",
"qubitOp = ferOp.mapping(map_type=map_type, threshold=0.00000001)\n",
"qubitOp = qubitOp.two_qubit_reduced_operator(num_particles) if qubit_reduction else qubitOp\n",
"qubitOp = Z2Symmetries.two_qubit_reduction(qubitOp, num_particles) if qubit_reduction else qubitOp\n",
"qubitOp.chop(10**-10)\n",
"\n",
"print(qubitOp.print_operators())\n",
"print(qubitOp.print_details())\n",
"print(qubitOp)"
]
},
Expand Down Expand Up @@ -316,7 +317,7 @@
"### [Optional] Setup token to run the experiment on a real device\n",
"If you would like to run the experiement on a real device, you need to setup your account first.\n",
"\n",
"Note: If you do not store your token yet, use `IBMQ.save_accounts()` to store it first."
"Note: If you do not store your token yet, use `IBMQ.save_account()` to store it first."
]
},
{
Expand All @@ -326,7 +327,7 @@
"outputs": [],
"source": [
"# from qiskit import IBMQ\n",
"# IBMQ.load_accounts()"
"# IBMQ.load_account()"
]
},
{
Expand All @@ -340,7 +341,7 @@
},
{
"cell_type": "code",
"execution_count": 8,
"execution_count": 10,
"metadata": {
"scrolled": true
},
Expand Down Expand Up @@ -396,13 +397,6 @@
"print('The total ground state energy is: {:.12f}'.format(results['eigvals'][0] + energy_shift + nuclear_repulsion_energy))\n",
"print(\"Parameters: {}\".format(results['opt_params']))"
]
},
{
"cell_type": "code",
"execution_count": null,
"metadata": {},
"outputs": [],
"source": []
}
],
"metadata": {
Expand Down
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