Quantum Monte Carlo

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Exchange energy

Last post by Neil Drummond « Tue May 06, 2025 4:09 pm
Replies: 1
by jiahuinie » Thu Nov 14, 2024 8:05 pm

1 Replies

41347 Views

Last post by Neil Drummond
Tue May 06, 2025 4:09 pm
Open Boundary Condition in CASINO

Last post by Neil Drummond « Tue May 06, 2025 3:58 pm
Replies: 1
by jiahuinie » Sun Nov 10, 2024 5:23 pm

1 Replies

16870 Views

Last post by Neil Drummond
Tue May 06, 2025 3:58 pm
Constrained derivatives.

Last post by Vladimir_Konjkov « Tue Oct 29, 2024 5:55 am
Replies: 10
by Vladimir_Konjkov » Tue Mar 07, 2023 8:34 am
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10 Replies

119575 Views

Last post by Vladimir_Konjkov
Tue Oct 29, 2024 5:55 am
Goodhart's law and VMC optimization.

Last post by Vladimir_Konjkov « Tue Dec 19, 2023 1:36 am
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by Vladimir_Konjkov » Mon Dec 18, 2023 6:11 am

2 Replies

59808 Views

Last post by Vladimir_Konjkov
Tue Dec 19, 2023 1:36 am
Backtranformed Jastrow

Last post by Neil Drummond « Sun Sep 25, 2022 2:47 pm
Replies: 1
by Vladimir_Konjkov » Sun Sep 25, 2022 12:34 pm

1 Replies

32602 Views

Last post by Neil Drummond
Sun Sep 25, 2022 2:47 pm
QMC symposium A8 at the 2022 Psi-k conference

Last post by Neil Drummond « Mon May 16, 2022 9:55 am

by Neil Drummond » Mon May 16, 2022 9:55 am

0 Replies

94939 Views

Last post by Neil Drummond
Mon May 16, 2022 9:55 am
DMC timestep bias asymptotic

Last post by Vladimir_Konjkov « Sun Aug 08, 2021 4:16 am
Replies: 17
by Vladimir_Konjkov » Fri Mar 09, 2018 6:27 am
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17 Replies

182226 Views

Last post by Vladimir_Konjkov
Sun Aug 08, 2021 4:16 am
electron-plasmon interaction

Last post by Neil Drummond « Fri Mar 09, 2018 12:04 pm
Replies: 1
by perez2014 » Thu Mar 01, 2018 10:33 am

1 Replies

44138 Views

Last post by Neil Drummond
Fri Mar 09, 2018 12:04 pm
trial/guiding wave function optimisation for DMC

Last post by Vladimir_Konjkov « Sun Jul 30, 2017 8:42 am
Replies: 6
by Vladimir_Konjkov » Wed Jul 19, 2017 4:15 am

6 Replies

69748 Views

Last post by Vladimir_Konjkov
Sun Jul 30, 2017 8:42 am
DMC energy

Last post by Vladimir_Konjkov « Thu Jun 15, 2017 3:31 pm
Replies: 21
by Fan_Wang » Tue Aug 02, 2016 9:29 am
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21 Replies

200665 Views

Last post by Vladimir_Konjkov
Thu Jun 15, 2017 3:31 pm
CECAM Workshop: Theoretical Chemistry for Extended Systems

Last post by Alexander_Hofmann « Mon Mar 27, 2017 1:32 pm

by Alexander_Hofmann » Mon Mar 27, 2017 1:32 pm

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116241 Views

Last post by Alexander_Hofmann
Mon Mar 27, 2017 1:32 pm
Regarding 1D QMC using external potential

Last post by KN_Pathak « Tue May 03, 2016 11:27 am
Replies: 8
by KN_Pathak » Thu Mar 17, 2016 10:13 am

8 Replies

84354 Views

Last post by KN_Pathak
Tue May 03, 2016 11:27 am
metal-insulator transition temperature from QMC?

Last post by perez2014 « Tue Mar 10, 2015 1:35 pm

by perez2014 » Tue Mar 10, 2015 1:35 pm

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Last post by perez2014
Tue Mar 10, 2015 1:35 pm
QMC at the research frontier

Last post by Mike Towler « Mon Mar 17, 2014 11:33 pm

by Mike Towler » Mon Mar 17, 2014 11:33 pm

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119345 Views

Last post by Mike Towler
Mon Mar 17, 2014 11:33 pm
Quantum monte carlo methods in biologocal chemistry

Last post by Mike Towler « Wed Oct 09, 2013 11:55 am
Replies: 1
by Jhalak » Mon Oct 07, 2013 9:09 am

1 Replies

50092 Views

Last post by Mike Towler
Wed Oct 09, 2013 11:55 am

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