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Self-Consistent Polarization of the Boundary in the Redistributed Charge and Dipole Scheme for Combined Quantum-Mechanical and Molecular-Mechanical Calculations

✍ Scribed by Zhang, Yan; Lin, Hai; Truhlar, Donald G.

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Redistributed Charge and Dipole Schemes

✍ Lin, Hai; Truhlar, Donald G. 📂 Article 📅 2005 🏛 American Chemical Society 🌐 English ⚖ 132 KB

Geometry optimization using tuned and ba

✍ Wang, Bo; Truhlar, Donald G. 📂 Article 📅 2011 🏛 Royal Society of Chemistry 🌐 English ⚖ 870 KB

Tuned and Balanced Redistributed Charge

✍ Wang, Bo; Truhlar, Donald G. 📂 Article 📅 2013 🏛 American Chemical Society 🌐 English ⚖ 238 KB

Generalized hybrid orbital for the treat

✍ Mireia Garcia-Viloca; Jiali Gao 📂 Article 📅 2003 🏛 Springer 🌐 English ⚖ 305 KB

The generalized hybrid orbital method fo

✍ Patricia Amara; Martin J. Field; Cristobal Alhambra; Jiali Gao 📂 Article 📅 2000 🏛 Springer 🌐 English ⚖ 157 KB

The development and validation of a pseu

✍ Zhang, Zhiqiang; Xu, Liancai; Wang, Guoqing; Shao, Chen; Jiang, Ling 📂 Article 📅 2014 🏛 Elsevier 🌐 English ⚖ 841 KB