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A derivative structure is a nonequivalent substitutional atomic configuration derived from a given primitive cell. The enumeration of derivative structures plays an essential role in searching for the ground states in multicomponent…

Computational Physics · Physics 2025-06-25 Kohei Shinohara , Atsuto Seko , Takashi Horiyama , Masakazu Ishihata , Junya Honda , Isao Tanaka

Zero-suppressed binary decision diagrams (ZDDs) are a data structure representing Boolean functions, and one of the most successful variants of binary decision diagrams (BDDs). On the other hand, BDDs are also called branching programs in…

Computational Complexity · Computer Science 2016-02-26 Hiroki Morizumi

This paper proposes an algorithmic framework for various reconfiguration problems using zero-suppressed binary decision diagrams (ZDDs), a data structure for families of sets. In general, a reconfiguration problem checks if there is a…

Data Structures and Algorithms · Computer Science 2022-12-19 Takehiro Ito , Jun Kawahara , Yu Nakahata , Takehide Soh , Akira Suzuki , Junichi Teruyama , Takahisa Toda

Zero-suppressed Binary Decision Diagrams (ZDDs) are data structures for representing set families in a compressed form. With ZDDs, many valuable operations on set families can be done in time polynomial in ZDD size. In some cases, however,…

Data Structures and Algorithms · Computer Science 2020-04-10 Kotaro Matsuda , Shuhei Denzumi , Kunihiko Sadakane

Partitioning a graph into balanced components is important for several applications. For multi-objective problems, it is useful not only to find one solution but also to enumerate all the solutions with good values of objectives. However,…

Data Structures and Algorithms · Computer Science 2018-04-09 Yu Nakahata , Jun Kawahara , Shoji Kasahara

Tensor networks have been successfully applied in simulation of quantum physical systems for decades. Recently, they have also been employed in classical simulation of quantum computing, in particular, random quantum circuits. This paper…

Quantum Physics · Physics 2025-07-08 Xin Hong , Xiangzhen Zhou , Sanjiang Li , Yuan Feng , Mingsheng Ying

A critical step in quantum compilation is the transformation of a technology-independent quantum circuit into a technology-dependent form for a targeted device. In addition to mapping quantum gates into the supported gate set, it is…

Quantum Physics · Physics 2020-05-04 Kaitlin Smith , Mathias Soeken , Bruno Schmitt , Giovanni De Micheli , Mitchell Thornton

Chain reduction enables reduced ordered binary decision diagrams (BDDs) and zero-suppressed binary decision diagrams (ZDDs) to each take advantage of the others' ability to symbolically represent Boolean functions in compact form. For any…

Data Structures and Algorithms · Computer Science 2017-10-19 Randal E. Bryant

Three different special quasirandom structures (SQS) of the substitutional hcp $A_{1-x}B_x$ binary random solutions ($x=0.25$, 0.5, and 0.75) are presented. These structures are able to mimic the most important pair and multi-site…

Materials Science · Physics 2007-08-30 Dongwon Shin , Raymundo Arróyave , Zi-Kui Liu , Axel van de Walle

In this paper, we present a simple combinatorial algorithm that solves symmetric diagonally dominant (SDD) linear systems in nearly-linear time. It uses very little of the machinery that previously appeared to be necessary for a such an…

Data Structures and Algorithms · Computer Science 2013-01-29 Jonathan A. Kelner , Lorenzo Orecchia , Aaron Sidford , Zeyuan Allen Zhu

In the last decade, decision diagrams (DDs) have been the basis for a large array of novel approaches for modeling and solving optimization problems. Many techniques now use DDs as a key tool to achieve state-of-the-art performance within…

Optimization and Control · Mathematics 2022-01-28 Margarita P. Castro , Andre A. Cire , J. Christopher Beck

The special quasirandom structure (SQS) method is widely used for modeling disordered materials under periodic boundary conditions, with the ATAT mcsqs module being one of the most established implementations. However, SQS generation with…

Materials Science · Physics 2026-03-23 Miroslav Lebeda , Jan Drahokoupil , Petr Vlčák , Šimon Svoboda , Axel van de Walle

Decision diagrams (DDs) have emerged as an efficient tool for simulating quantum circuits due to their capacity to exploit data redundancies in quantum states and quantum operations, enabling the efficient computation of probability…

Quantum Physics · Physics 2026-05-18 Vladimir Vargas-Calderón , Santiago Acevedo-Mancera , Herbert Vinck-Posada

Binary decision diagrams (BDDs) are widely used to mitigate the state-explosion problem in model checking. A variation of BDDs are Zero-suppressed Decision Diagrams (ZDDs) which omit variables that must be false, instead of omitting…

Logic in Computer Science · Computer Science 2023-07-12 Daniel Miedema , Malvin Gattinger

Decision diagrams for classification have some notable advantages over decision trees, as their internal connections can be determined at training time and their width is not bound to grow exponentially with their depth. Accordingly,…

Machine Learning · Computer Science 2022-05-31 Alexandre M. Florio , Pedro Martins , Maximilian Schiffer , Thiago Serra , Thibaut Vidal

An ordered binary decision diagram (OBDD) is a directed acyclic graph that represents a Boolean function. OBDDs are also known as special cases of oblivious read-once branching programs in the field of complexity theory. Since OBDDs have…

Quantum Physics · Physics 2025-05-19 Seiichiro Tani

Well-structured systems, aka WSTSs, are computational models where the set of possible configurations is equipped with a well-quasi-ordering which is compatible with the transition relation between configurations. This structure supports…

Logic in Computer Science · Computer Science 2014-02-13 Sylvain Schmitz , Philippe Schnoebelen

Modeling decision-dependent scenario probabilities in stochastic programs is difficult and typically leads to large and highly non-linear MINLPs that are very difficult to solve. In this paper, we develop a new approach to obtain a compact…

Optimization and Control · Mathematics 2017-01-18 Utz-Uwe Haus , Carla Michini , Marco Laumanns

A recently proposed canonical form of Boolean functions, namely tagged sentential decision diagrams (TSDDs), exploits both the standard and zero-suppressed trimming rules. The standard ones minimize the size of sentential decision diagrams…

Artificial Intelligence · Computer Science 2023-12-05 Deyuan Zhong , Mingwei Zhang , Quanlong Guan , Liangda Fang , Zhaorong Lai , Yong Lai

This paper proposes a novel approach to Hamiltonian simulation using Decision Diagrams (DDs), which are an exact representation based on exploiting redundancies in representations of quantum states and operations. While the simulation of…

Quantum Physics · Physics 2024-03-04 Aaron Sander , Lukas Burgholzer , Robert Wille
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