[QE-users] 答复: DFT-D3 in QE6.3

[LEUNG Clarence]

Dear Paolo,

Can the  BJ-damping be used in QE6.3? if yes, what is the command in the input file?

LIANG Xiongyi
________________________________
发件人: users <users-bounces at lists.quantum-espresso.org> 代表 Paolo Giannozzi <p.giannozzi at gmail.com>
发送时间: 2018年11月6日 21:44
收件人: Quantum Espresso users Forum
主题: Re: [QE-users] DFT-D3 in QE6.3

Please see file README in the dft-d3/ subdirectory.

Paolo

Il mar 6 nov 2018 14:01 LEUNG Clarence <liangxy123 at hotmail.com<mailto:liangxy123 at hotmail.com>> ha scritto:
Dear UE users,

Could you please tell me the reference of DFT-D3 in QE6.3?

Thanks.

LIANG Xiongyi
PhD candidate
CItyu
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