Energy partitioning for “fuzzy” atoms

نویسندگان
چکیده

برای دانلود باید عضویت طلایی داشته باشید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Energy partitioning for "fuzzy" atoms.

The total energy of a molecule is presented as a sum of one- and two-atomic energy components in terms of "fuzzy" atoms, i.e., such divisions of the three-dimensional physical space into atomic regions in which the regions assigned to the individual atoms have no sharp boundaries but exhibit a continuous transition from one to another. By proper definitions the energy components are on the chem...

متن کامل

FUZZY GOULD INTEGRABILITY ON ATOMS

In this paper we study the relationships existing between total measurability in variation and Gould type fuzzy integrability (introduced and studied in [21]), giving a special interest on their behaviour on atoms and on finite unions of disjoint atoms. We also establish that any continuous real valued function defined on a compact metric space is totally measurable in the variation of a regula...

متن کامل

fuzzy gould integrability on atoms

in this paper we study the relationships existing between total measurability in variation and gould type fuzzy integrability (introduced and studied in [21]), giving a special interest on their behaviour on atoms and on finite unions of disjoint atoms. we also establish that any continuous real valued function defined on a compact metric space is totally measurable in the variation of a regula...

متن کامل

Effective atomic orbitals for fuzzy atoms.

The method of extracting effective atomic orbitals and effective minimal basis sets from molecular wave function characterizing the state of an atom in a molecule is developed in the framework of the "fuzzy" atoms. In all cases studied, there were as many effective orbitals that have considerable occupation numbers as orbitals in the classical minimal basis. That is considered to be of high con...

متن کامل

ENERGY AWARE DISTRIBUTED PARTITIONING DETECTION AND CONNECTIVITY RESTORATION ALGORITHM IN WIRELESS SENSOR NETWORKS

 Mobile sensor networks rely heavily on inter-sensor connectivity for collection of data. Nodes in these networks monitor different regions of an area of interest and collectively present a global overview of some monitored activities or phenomena. A failure of a sensor leads to loss of connectivity and may cause partitioning of the network into disjoint segments. A number of approaches have be...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

ژورنال

عنوان ژورنال: The Journal of Chemical Physics

سال: 2004

ISSN: 0021-9606,1089-7690

DOI: 10.1063/1.1646354