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Baijianlu / AICON2

AICON2: A program for calculating transport properties quickly and accurately
GNU General Public License v3.0
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AICON2 for 2D Materials #7

Open roviABV opened 2 years ago

roviABV commented 2 years ago

Dear Developer(s),

I would like to ask if this package can also do electron and phonon transport calculations for 2D materials.

Thank you.

Baijianlu commented 2 years ago

Hello,

For now, the program cannot do calculation for 2D materials. It lacks model for boundary scattering, which should be important for 2D materials.

From: roviABV @.***> Sent: 24 August 2022 10:31:56 To: Baijianlu/AICON2 Cc: Subscribed Subject: [Baijianlu/AICON2] AICON2 for 2D Materials (Issue #7)

Dear Developer(s),

I would like to ask if this package can also do electron and phonon transport calculations for 2D materials.

Thank you.

— Reply to this email directly, view it on GitHubhttps://github.com/Baijianlu/AICON2/issues/7, or unsubscribehttps://github.com/notifications/unsubscribe-auth/ALVGKXN5K7V65OPCXARSE7TV2XFWZANCNFSM57OF6K6A. You are receiving this because you are subscribed to this thread.Message ID: @.***>

GuoqingSun-hust commented 1 year ago

Hello, For now, the program cannot do calculation for 2D materials. It lacks model for boundary scattering, which should be important for 2D materials. … ____ From: roviABV @.> Sent: 24 August 2022 10:31:56 To: Baijianlu/AICON2 Cc: Subscribed Subject: [Baijianlu/AICON2] AICON2 for 2D Materials (Issue #7) Dear Developer(s), I would like to ask if this package can also do electron and phonon transport calculations for 2D materials. Thank you. — Reply to this email directly, view it on GitHub<#7>, or unsubscribehttps://github.com/notifications/unsubscribe-auth/ALVGKXN5K7V65OPCXARSE7TV2XFWZANCNFSM57OF6K6A. You are receiving this because you are subscribed to this thread.Message ID: @.>

Hi developers: Could you explain the boundary scattering in 2D materials in more details, do you mean the scattering events in the limited dimension ( usually z direction )?

And i have another question. Since the input phonon information is not specified as 3rd ifcs, can i assume that the output thermal conductivity is the result with considering the 4th ifcs ( or higher ) ?

Baijianlu commented 1 year ago

generally yes. the length in z direction is in nano scale, which usually having quantum confinement effect for electron and phonon transport.

From: GuoqingSun-hust @.***> Sent: 01 November 2022 04:45:15 To: Baijianlu/AICON2 Cc: Tao Fan; Comment Subject: Re: [Baijianlu/AICON2] AICON2 for 2D Materials (Issue #7)

Hello, For now, the program cannot do calculation for 2D materials. It lacks model for boundary scattering, which should be important for 2D materials. … ____ From: roviABV @.> Sent: 24 August 2022 10:31:56 To: Baijianlu/AICON2 Cc: Subscribed Subject: [Baijianlu/AICON2] AICON2 for 2D Materials (Issue #7https://github.com/Baijianlu/AICON2/issues/7) Dear Developer(s), I would like to ask if this package can also do electron and phonon transport calculations for 2D materials. Thank you. — Reply to this email directly, view it on GitHub<#7https://github.com/Baijianlu/AICON2/issues/7>, or unsubscribehttps://github.com/notifications/unsubscribe-auth/ALVGKXN5K7V65OPCXARSE7TV2XFWZANCNFSM57OF6K6A. You are receiving this because you are subscribed to this thread.Message ID: @.>

Hi developers: Could you explain the boundary scattering in 2D materials in more details, do you mean the scattering events in the limited dimension ( usually z direction )?

— Reply to this email directly, view it on GitHubhttps://github.com/Baijianlu/AICON2/issues/7#issuecomment-1297904516, or unsubscribehttps://github.com/notifications/unsubscribe-auth/ALVGKXLHA4DILABMSL4SZ4TWGBY2XANCNFSM57OF6K6A. You are receiving this because you commented.Message ID: @.***>