upward

Intermolecular forces

D Micha, Molecular Interactions: Concepts and Methods (Wiley, 2020) – е

I G Kaplan, Intermolecular Interactions: Physical Picture, Computational Methods and Model Potentials (Wiley, 2006) – е

V A Parsegian, Van der Waals forces (CUP, 2006)

A J Stone, The theory of intermolecular forces (OUP, 1997) – google

J N Israelachvili, Intermolecular and surface forces (AP, 1992) – е

Хобза П, Заградник Р, Межмолекулярные комплексы (Мир, 1989) – е

Бараш Ю С, Силы Ван-дер-Ваальса (Наука, 1988) – е

A Bondi, Van der Waals volumes and radii, J Phys Chem 68, 441 (1964) – е


A Salam, Long-Range Interparticle Interactions, RCC 29, 98 (2016)

D Dougherty, The Cation-pi Interaction, ACR 46, 885 (2013)

K Riley, P Hobza, Noncovalent interactions in biochemistry, WCMS 1, 3 (2011)

R French, V Parsegian, R Podgornik,..., O von Lilienfeld, C van Oss, T Zemb, Long range interactions in nanoscale science, RMP 82, 1887 (2010)

Methods

SAPT - Symmetry-Adapted Perturbation Theory

EFPDB - Effective Fragment Potenial Database (Slipchenko)


P Xu, M Alkan, M Gordon, Many-Body Dispersion, CR 120, 12343 (2020)

J Garcia, R Podeszwa, K Szalewicz, SAPT codes for calculations of intermolecular interaction energies, JCP 152, 184109 (2020) – е

K Patkowski, Recent developments in symmetry-adapted perturbation theory, WCMS 10, e1452 (2019)

L M Woods, D A R Dalvit, A Tkatchenko, P Rodriguez-Lopez, A W Rodriguez, R Podgornik, Materials perspective on Casimir and van der Waals interactions, RMP 88, 045003 (2016) – е

R A DiStasio Jr, V V Gobre, A Tkatchenko, Many-body van der Waals interactions in molecules and condensed matter, JPC 26, 213202 (2014) – е

M S Gordon, Q A Smith, P Xu, L V Slipchenko, Accurate First Principles Model Potentials for Intermolecular Interactions, ARPC 64, 553 (2013) – е

C D Sherrill, Computations of noncovalent pi interactions, RCC 26, 1 (2009) – е

B Jeziorski, R Moszynski, K Szalewicz, Perturbation theory approach to intermolecular potential energy surfaces of van der Waals complexes, CR 94, 1887 (1994) – е


R Sure, S Grimme, Comprehensive Benchmark of Association (Free) Energies of Realistic Host-Guest Complexes, JCTC 11, 3785 (2015) – doi, zip, S30L dataset

R Sedlak, T Janowski, M Pitonak, J Rezac, P Pulay, P Hobza, Accuracy of Quantum Chemical Methods for Large Noncovalent Complexes, JCTC 9, 3364 (2013) – doi, L7 dataset

C A Morgado, J P McNamara, I H Hillier, N A Burton, M A Vincent, Density functional and semiempirical molecular orbital methods including dispersion corrections for the accurate description of noncovalent interactions involving sulfur-containing molecules, JCTC 3, 1656 (2007) – е