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== BDF binary code == | At present, BDF source code is only open for developers. For people who are interested in developing the BDF package, please contact Prof. Wenjian Liu (liuwj#sdu.edu.cn, replace # by @) directly. |
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From Jan. 1, 2021. BDF is distributed via Hongzhiwei. Please contact Hongzhiwei. At present, BDF source code is only open for developers. For people who are interested in developing the BDF package, contact Prof. Wenjian Liu directly. |
Besides, the binary executables of the commercialized version of BDF, which only includes a part of all the functionalities of BDF (SCF and TD-DFT, including their gradients and response properties, in particular SOCME and NACME; geometry optimization and frequency calculations; energy transfer integrals and electron transfer integrals; QM/MM; solvation models; fragmentation methods), are available with a free trial period. People interested in the binaries may apply for a free trial after registering at https://iresearch.net.cn/web/personal-space/activity-page (in Chinese), or by sending an email to sales@hzwtech.com. |
Download BDF package
At present, BDF source code is only open for developers. For people who are interested in developing the BDF package, please contact Prof. Wenjian Liu (liuwj#sdu.edu.cn, replace # by @) directly.
Besides, the binary executables of the commercialized version of BDF, which only includes a part of all the functionalities of BDF (SCF and TD-DFT, including their gradients and response properties, in particular SOCME and NACME; geometry optimization and frequency calculations; energy transfer integrals and electron transfer integrals; QM/MM; solvation models; fragmentation methods), are available with a free trial period. People interested in the binaries may apply for a free trial after registering at https://iresearch.net.cn/web/personal-space/activity-page (in Chinese), or by sending an email to sales@hzwtech.com.