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result.txt
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基本的VQE：
==========================Circuit Summary==========================
|Total number of gates : 5190. |
|Parameter gates : 220. |
|with 20 parameters are : |
|p0, p5, p1, p6, p2, p7, p3, p8, p4, p9.. .|
|Number qubit of circuit: 12 |
===================================================================
Molecule: H1-F1_sto3g_singlet
Number of parameters: 20
Optimization completed at step 10
Optimized energy: -98.6017913818359375
Runtime by CPU: 2.2354494207538664 s
Runtime by GPU: 4.358639398997184 s
============================Circuit Summary============================
|Total number of gates : 15172. |
|Parameter gates : 640. |
|with 44 parameters are : |
|p0, p8, p1, p9, p2, p10, p3, p11, p4, p12.. . |
|Number qubit of circuit: 12 |
=======================================================================
Molecule: H1-Li1_sto3g_singlet
Number of parameters: 44
Optimization completed at step 65
Optimized energy: -7.8825187683105469
Runtime by CPU: 29.830108074937016 s
Runtime by GPU: 25.080039207008667 s
=============================Circuit Summary=============================
|Total number of gates : 25090. |
|Parameter gates : 1000. |
|with 65 parameters are : |
|p0, p10, p1, p11, p2, p12, p3, p13, p4, p14.. . |
|Number qubit of circuit: 14 |
=========================================================================
Molecule: H2-O1_sto3g_singlet
Number of parameters: 65
Optimization completed at step 29
Optimized energy: -75.0203170776367188
Runtime by CPU: 45.17390292370692 s
Runtime by GPU: 20.630317924005794 s
=============================Circuit Summary=============================
|Total number of gates : 37366. |
|Parameter gates : 1488. |
|with 90 parameters are : |
|p0, p12, p1, p13, p2, p14, p3, p15, p4, p16.. . |
|Number qubit of circuit: 14 |
=========================================================================
Molecule: H2-Be1_sto3g_singlet
Number of parameters: 90
Optimization completed at step 49
Optimized energy: -15.5944061279296875
Runtime by CPU: 68.93877846095711 s
Runtime by GPU: 48.1251737089915 s
=============================Circuit Summary=============================
|Total number of gates : 61950. |
|Parameter gates : 2340. |
|with 135 parameters are: |
|p0, p15, p1, p16, p2, p17, p3, p18, p4, p19.. . |
|Number qubit of circuit: 16 |
=========================================================================
Molecule: H3-N1_sto3g_singlet
Number of parameters: 135
Optimization completed at step 35
Optimized energy: -55.5243492126464844
Runtime by CPU: 232.5523607879877 s
Runtime by GPU: 61.959667214003275 s
=============================Circuit Summary=============================
|Total number of gates : 118010. |
|Parameter gates : 4240. |
|with 230 parameters are: |
|p0, p20, p1, p21, p2, p22, p3, p23, p4, p24.. . |
|Number qubit of circuit: 18 |
=========================================================================
Molecule: H4-C1_sto3g_singlet
Number of parameters: 230
Optimization completed at step 27
Optimized energy: -39.8048553466796875
Runtime by CPU: 674.6131395227276 s
Runtime by GPU: 170.10553442299715 s
Sym优化的VQE：
===================================Circuit Summary===================================
|Total number of gates : 2142. |
|Parameter gates : 100. |
|with 11 parameters are : |
|s_0, d1_0, s_1, d1_1, s_2, d1_2, d1_3, d1_4, d2_0, d2_1.. . |
|Number qubit of circuit: 12 |
=====================================================================================
Molecule: H1-F1_sto3g_singlet
Number of parameters: 11
Optimization completed at step 10
Optimized energy: -98.6017913818359375
Runtime by CPU: 1.3096084757708013 s
Runtime by GPU: 3.254543195987935 s
===================================Circuit Summary===================================
|Total number of gates : 5316. |
|Parameter gates : 224. |
|with 20 parameters are : |
|s_0, d1_0, s_1, d1_1, d1_2, d1_3, d1_4, d1_5, s_6, d1_6.. . |
|Number qubit of circuit: 12 |
=====================================================================================
Molecule: H1-Li1_sto3g_singlet
Number of parameters: 20
Optimization completed at step 39
Optimized energy: -7.8825168609619141
Runtime by CPU: 6.749904905911535 s
Runtime by GPU: 7.709208079002565 s
===================================Circuit Summary===================================
|Total number of gates : 7818. |
|Parameter gates : 336. |
|with 26 parameters are : |
|s_0, d1_0, s_1, d1_1, d1_2, s_3, d1_3, d1_4, d1_5, d1_6.. . |
|Number qubit of circuit: 14 |
=====================================================================================
Molecule: H2-O1_sto3g_singlet
Number of parameters: 26
Optimization completed at step 12
Optimized energy: -75.0203247070312500
Runtime by CPU: 8.592032148968428 s
Runtime by GPU: 5.775155804993119 s
===================================Circuit Summary===================================
|Total number of gates : 5890. |
|Parameter gates : 268. |
|with 23 parameters are : |
|d1_0, d1_1, d1_2, d1_3, d1_4, d1_5, s_6, d1_6, s_7, d1_7.. .|
|Number qubit of circuit: 14 |
=====================================================================================
Molecule: H2-Be1_sto3g_singlet
Number of parameters: 23
Optimization completed at step 31
Optimized energy: -15.5944051742553711
Runtime by CPU: 10.005716532003134 s
Runtime by GPU: 7.275199955009157 s
==================================Circuit Summary==================================
|Total number of gates : 30934. |
|Parameter gates : 1196. |
|with 75 parameters are : |
|s_0, d1_0, s_1, d1_1, d1_2, s_3, d1_3, s_4, d1_4, s_5.. . |
|Number qubit of circuit: 16 |
===================================================================================
Molecule: H3-N1_sto3g_singlet
Number of parameters: 75
Optimization completed at step 32
Optimized energy: -55.5244064331054688
Runtime by CPU: 92.53053297195584 s
Runtime by GPU: 29.134165089999442 s
===================================Circuit Summary===================================
|Total number of gates : 30974. |
|Parameter gates : 1108. |
|with 65 parameters are : |
|d1_0, d1_1, s_2, d1_2, d1_3, d1_4, d1_5, d1_6, d1_7, s_8.. .|
|Number qubit of circuit: 18 |
=====================================================================================
Molecule: H4-C1_sto3g_singlet
Number of parameters: 65
Optimization completed at step 23
Optimized energy: -39.7706413269042969
Runtime by CPU: 167.94873534096405 s
Runtime by GPU: 52.31754236698907 s